SCHEMBL12724913

SCHEMBL12724913

CCN(CC)c1ccc2c(-c3ccccc3C(=O)Cl)c3ccc(=[N+](CC)CC)cc-3oc2c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.60
▸ BLM P54132 2/20 0.60
▸ KMT2A Q03164 2/20 0.60
▸ USP2 O75604 1/20 0.60
▸ POLB P06746 1/20 0.60
▸ PPARG P37231 1/20 0.60
▸ RXFP1 Q9HBX9 1/20 0.60
▸ NCOR2 Q9Y618 1/20 0.60
▸ FPR2 P25090 4/20 0.53
▸ TGM2 P21980 1/20 0.53
▸ CHRM1 P11229 1/20 0.47
▸ TLR7 Q9NYK1 1/20 0.46
▸ AVPR2 P30518 3/20 0.44
▸ THRB P10828 1/20 0.44
▸ RECQL P46063 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ P2RY6 Q15077 1/20 0.42
▸ NPY4R P50391 3/20 0.42
▸ SLC6A2 P23975 1/20 0.40
▸ SLC6A4 P31645 1/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL19274786 0.92 MEN1 (0.51) MEN1BLMKMT2AUSP2POLB
Rhodamine B SCHEMBL10000882 0.92 MEN1 (0.61) MEN1BLMKMT2AUSP2POLB
SCHEMBL29593395 0.92 MEN1 (0.61) MEN1BLMKMT2AUSP2POLB
SCHEMBL3903552 0.92 MEN1 (0.61) MEN1BLMKMT2AUSP2POLB
SCHEMBL17663659 0.91 MEN1 (0.60) MEN1BLMKMT2AUSP2POLB
Hydrochloric Acid SCHEMBL30207638 0.91 MEN1 (0.60) MEN1BLMKMT2AUSP2POLB
Hydrochloric Acid SCHEMBL29354092 0.91 MEN1 (0.60) MEN1BLMKMT2AUSP2POLB
Hydrochloric Acid SCHEMBL18617 0.91 MEN1 (0.60) MEN1BLMKMT2AUSP2POLB
SCHEMBL20078093 0.91 MEN1 (0.63) MEN1BLMKMT2AUSP2POLB
SCHEMBL17552990 0.91 MEN1 (0.63) MEN1BLMKMT2AUSP2POLB

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 18 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10640513-B2 Compound and composition for detecting phosgene and diethyl chlorophosphate EWHA UNIVERSITY - INDUSTRY COLLABORATION FOUNDATION (KR) 2020-05-05 — — US disclosed
US-9952231-B2 Lysophosphatidic acid detection PORTLAND STATE UNIVERSITY (US) 2018-04-24 — — US disclosed
EP-2970325-B1 LYSOPHOSPHATIDIC ACID DETECTION UNIV PORTLAND STATE (US) 2017-09-27 — — EP disclosed
WO-2017146400-A1 COMPOUND AND COMPOSITION FOR DETECTING PHOSGENE AND DIETHYL CHLOROPHOSPHATE EWHA UNIVERSITY - INDUSTRY COLLABORATION FOUNDATION (KR) 2017-08-31 — — WO disclosed
US-20170240557-A1 COMPOUND AND COMPOSITION FOR DETECTING PHOSGENE AND DIETHYL CHLOROPHOSPHATE EWHA UNIVERSITY - INDUSTRY COLLABORATION FOUNDATION (KR) 2017-08-24 — — US disclosed
US-20170096528-A1 COMPOSITION FOR PREPARING HYBRID RESIN, HYBRID RESIN AND HYBRID RESIN FILM PREPARED THEREFROM Sogang University Research Foundation (KR) 2017-04-06 — — US disclosed
US-9605101-B2 Pigment multimer, coloring composition, cured film, color filter, method for manufacturing color filter, solid-state imaging element, and image display device FUJIFILM CORPORATION (JP) 2017-03-28 — — US disclosed
US-9605101-B2 Pigment multimer, coloring composition, cured film, color filter, method for manufacturing color filter, solid-state imaging element, and image display device FUJIFILM CORPORATION (JP) 2017-03-28 — — US disclosed
US-20160122547-A1 METHOD FOR PRODUCING DYE MULTIMER, AND METHOD FOR PRODUCING COLORING COMPOSITION FUJIFILM CORPORATION (JP) 2016-05-05 — — US disclosed
US-20160108161-A1 PIGMENT MULTIMER, COLORING COMPOSITION, CURED FILM, COLOR FILTER, METHOD FOR MANUFACTURING COLOR FILTER, SOLID-STATE IMAGING ELEMENT, AND IMAGE DISPLAY DEVICE FUJIFILM CORPORATION (JP) 2016-04-21 — — US disclosed
US-20160108161-A1 PIGMENT MULTIMER, COLORING COMPOSITION, CURED FILM, COLOR FILTER, METHOD FOR MANUFACTURING COLOR FILTER, SOLID-STATE IMAGING ELEMENT, AND IMAGE DISPLAY DEVICE FUJIFILM CORPORATION (JP) 2016-04-21 — — US disclosed
WO-2014144561-A2 LYSOPHOSPHATIDIC ACID DETECTION THE OREGON STATE BOARD OF HIGHER EDUCATION ACTING BY AND THROUGH PORTLAND STATE UNIVERSITY (US) 2014-09-18 — — WO disclosed
US-20110092678-A1 SINGLE-LABELLING AGENTS BASED ON VINYL SULPHONE UNIVERSIDAD DE GRANADA (ES) 2011-04-21 — — US disclosed
US-20110065164-A1 DOUBLE-LABELLING AGENTS BASED ON VINYL SULPHONE UNIVERSIDAD DE GRANADA (ES) 2011-03-17 — — US disclosed
WO-2009106664-A1 SINGLE-LABELLING AGENTS BASED ON VINYL SULPHONE UNIVERSIDAD DE GRANADA (ES) 2009-09-03 — — WO disclosed
WO-2009106665-A1 DOUBLE-LABELLING AGENTS BASED ON VINYL SULPHONE UNIVERSIDAD DE GRANADA (ES) 2009-09-03 — — WO disclosed
US-20080214811-A1 XANTHENE DYES BIOSEARCH TECHNOLOGIES, INC. (US) 2008-09-04 — — US disclosed
US-7344701-B2 Xanthene dyes BIOSEARCH TECHNOLOGIES, INC. (US) 2008-03-18 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160108161-A1 PIGMENT MULTIMER, COLORING COMPOSITION, CURED FILM, COLOR FILTER, METHOD FOR MANUFACTURING COLOR FILTER, SOLID-STATE IMAGING ELEMENT, AND IMAGE DISPLAY DEVICE CUTA, SLC5A6, SETDB1 MEN1 31/4885BLM 530/4885KMT2A 143/4885
US-10640513-B2 Compound and composition for detecting phosgene and diethyl chlorophosphate DCPS, DCTPP1, PPIP5K2 MEN1 2097/4885BLM 2017/4885KMT2A 3730/4885
US-20080214811-A1 XANTHENE DYES ANXA5, ANTXR2, XPOT MEN1 894/4885BLM 1267/4885KMT2A 4043/4885
US-20170240557-A1 COMPOUND AND COMPOSITION FOR DETECTING PHOSGENE AND DIETHYL CHLOROPHOSPHATE DCPS, DCTPP1, PPIP5K2 MEN1 2097/4885BLM 2017/4885KMT2A 3730/4885
US-20110065164-A1 DOUBLE-LABELLING AGENTS BASED ON VINYL SULPHONE SUMO2, VCL, NEDD4 MEN1 4132/4885BLM 4051/4885KMT2A 342/4885
US-20110092678-A1 SINGLE-LABELLING AGENTS BASED ON VINYL SULPHONE VCL, NEDD4, TMT1A MEN1 3702/4885BLM 4145/4885KMT2A 474/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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