SCHEMBL258780

SCHEMBL258780

O=C(CCC(=O)OC1CCCCC1)OC1CCCCC1

nearest known ligand 0.66

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 2/20 0.66
CYP2C19 P33261 1/20 0.57
HTT P42858 1/20 0.53
EPHX1 P07099 2/20 0.50
CYP19A1 P11511 2/20 0.50
SMN1; SMN2 Q16637 3/20 0.46
ALDH1A1 P00352 4/20 0.44
LMNA P02545 3/20 0.44
KDM4E B2RXH2 2/20 0.44
HPGD P15428 2/20 0.44
CA12 O43570 2/20 0.43
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43
CA9 Q16790 2/20 0.43
TSHR P16473 1/20 0.40
HSD17B10 Q99714 1/20 0.39
RAB9A P51151 1/20 0.38

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
SCHEMBL7568980 1.00 NAAA (0.66) NAAACYP2C19HTTEPHX1CYP19A1
SCHEMBL31069913 1.00 NAAA (0.66) NAAACYP2C19HTTEPHX1CYP19A1
SCHEMBL207015 0.97 NAAA (0.64) NAAACYP2C19HTTEPHX1CYP19A1
SCHEMBL31302650 0.93 NAAA (0.59) NAAACYP2C19HTTEPHX1CYP19A1
SCHEMBL28448079 0.92 NAAA (0.59) NAAACYP2C19HTTEPHX1CYP19A1
SCHEMBL3472508 0.91 NAAA (0.58) NAAACYP2C19HTTEPHX1CYP19A1
Cyclohexane SCHEMBL27646533 0.91 NAAA (0.58) NAAACYP2C19HTTEPHX1CYP19A1
SCHEMBL22213807 0.91 NAAA (0.58) NAAACYP2C19HTTEPHX1CYP19A1
SCHEMBL207867 0.91 NAAA (0.79) NAAACYP2C19HTTEPHX1CYP19A1
SCHEMBL17675641 0.91 NAAA (0.79) NAAACYP2C19HTTEPHX1CYP19A1

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 281 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12207545-B2 Phosphorescent PtM2 (m=Cu,Ag,Au) complex and organic light-emitting diode thereof FUJIAN INSTITUTE OF RESEARCH ON THE STRUCTURE OF MATTER, CHINESE ACADEMY (CN) 2025-01-21 US claimed
CN-118530412-A Binder for negative electrode, negative electrode slurry, negative electrode, and lithium battery 深圳好电科技有限公司 2024-08-23 CN claimed
US-12037715-B2 Semi-aromatic polyamide fiber and method for producing same KURARAY CO., LTD. (JP) 2024-07-16 US claimed
US-11873407-B2 Diketopyrrolopyrrole pigment compound having high weathering resistance and preparation method therof CINIC CHEMICALS (SHANGHAI) CO., LTD. (CN) 2024-01-16 US claimed
CN-115109430-A Pigment and preparation method thereof 宁夏彩妍科技有限公司 2022-09-27 CN claimed
US-20220059782-A1 PHOSPHORESCENT PtM2 (M=Cu,Ag,Au) COMPLEX AND ORGANIC LIGHT-EMITTING DIODE THEREOF FUJIAN INSTITUTE OF RESEARCH ON THE STRUCTURE OF MATTER, CHINESE ACADEMY OF SCIENCES (CN) 2022-02-24 US claimed
US-20210179855-A1 DIKETOPYRROLOPYRROLE PIGMENT COMPOUND HAVING HIGH WEATHERING RESISTANCE, PREPARATION METHOD THERFOR, AND USE THEROF CINIC CHEMICALS (SHANGHAI) CO., LTD. (CN) 2021-06-17 US claimed
EP-3733783-A1 DIKETOPYRROLOPYRROLE PIGMENT COMPOUND HAVING HIGH WEATHER RESISTANCE, PREPARATION METHOD THEREFOR AND USE THEREOF Cinic Chemicals Shanghai Co. Ltd. (CN) 2020-11-04 EP claimed
CN-106608937-A Catalyst component for olefin polymerization, preparation method and application thereof 中国石油化工股份有限公司 2017-05-03 CN claimed
CN-106608933-A Catalyst component for olefin polymerization, preparation method and application thereof 中国石油化工股份有限公司 2017-05-03 CN claimed
US-5683793-A Ink jet transparencies XEROX CORPORATION (US) 1997-11-04 US claimed
CN-1147499-A Process for the preparation of cyclohexanol and cyclohexanone XIAO ZAOSHENG (CN) 1997-04-16 CN claimed
US-5589277-A INK JET PRINTING, AQUEOUS INKS, FAST DRYING XEROX CORPORATION (US) 1996-12-31 US claimed
US-5492564-A HIGH OPACITY, COLORFASTNESS CIBA-GEIGY CORPORATION (US) 1996-02-20 US claimed
CN-1113251-A Diketopyrrolopyrrole pigment with high chroma CIBA GEIGY AG (CH) 1995-12-13 CN claimed
EP-0667246-A1 Recording sheets containing amino acids, hydroxy acids, and polycarboxyl compounds XEROX CORPORATION (US) 1995-08-16 EP claimed
EP-0302018-B1 Process for the preparation of pyrrolo [3,4-c] pyrroles CIBA GEIGY AG (CH) 1993-11-03 EP claimed
US-4931566-A Process for the preparation of pyrrolo[3,4-c]pyrroles CIBA-GEIGY CORPORATION (US) 1990-06-05 US claimed
US-4579949-A REACTING DISUCCINATE WITH NITRILES CIBA-GEIGY CORPORATION (US) 1986-04-01 US claimed
US-4174391-A ANIMAL GROWTH REGULATORS MAY & BAKER LIMITED (GB) 1979-11-13 US claimed

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

For each of this compound's patents that has machine-readable text (2 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-12207545-B2 Phosphorescent PtM2 (m=Cu,Ag,Au) complex and organic light-emitting diode thereof ITGA2, METTL3, EIF2A NAAA 3654/4885CYP2C19 3677/4885HTT 2705/4885
US-20220059782-A1 PHOSPHORESCENT PtM2 (M=Cu,Ag,Au) COMPLEX AND ORGANIC LIGHT-EMITTING DIODE THEREOF ITGA2, METTL3, EIF2A NAAA 3654/4885CYP2C19 3677/4885HTT 2705/4885

“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.