SCHEMBL3074874

SCHEMBL3074874

NCC(=O)NCCNC(=O)CN

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA2 P00918 3/20 0.44
CA1 P00915 2/20 0.44
ALDH1A1 P00352 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
GLRA1 P23415 1/20 0.39
SLC6A9 P48067 1/20 0.39
OR51E2 Q9H255 1/20 0.39
MMP2 P08253 1/20 0.36
AOC3 Q16853 2/20 0.35
GABRR1 P24046 1/20 0.35
CACNA1G O43497 1/20 0.34
TERT O14746 1/20 0.33
PAOX Q6QHF9 1/20 0.33
KDM4E B2RXH2 1/20 0.33
KDM5C P41229 1/20 0.33
PHF8 Q9UPP1 1/20 0.33
KDM2A Q9Y2K7 1/20 0.33

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
SCHEMBL18160754 0.91 CA2 (0.40) CA2CA1ALDH1A1SMN1; SMN2MEN1
SCHEMBL19776089 0.89 CA2 (0.39) CA2CA1ALDH1A1SMN1; SMN2MEN1
SCHEMBL28969880 0.89 CA1 (0.39) CA2CA1ALDH1A1SMN1; SMN2MEN1
SCHEMBL16853212 0.88 ALDH1A1 (0.55) CA2CA1ALDH1A1SMN1; SMN2MEN1
SCHEMBL12660515 0.88 MEN1 (0.48) CA2CA1ALDH1A1SMN1; SMN2MEN1
SCHEMBL152135 0.88
Hydrochloric Acid SCHEMBL25330006 0.87 CA1 (0.38) CA2CA1ALDH1A1MEN1KMT2A
SCHEMBL12655123 0.87
SCHEMBL4391001 0.87 PAOX (0.52) CA2CA1ALDH1A1MEN1KMT2A
SCHEMBL14198854 0.85 ALDH1A1 (0.59) ALDH1A1SMN1; SMN2MEN1KMT2APAOX

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10184052-B2 Near infrared radiation-absorbing composition, near infrared radiation cut-off filter and production method therefor, and camera module and production method therefor FUJIFILM CORPORATION (JP) 2019-01-22 US disclosed
US-20180094086-A1 NEAR INFRARED ABSORBING COMPOSITION, NEAR INFRARED CUT FILTER, METHOD OF MANUFACTURING NEAR INFRARED CUT FILTER, DEVICE, METHOD OF MANUFACTURING COPPER-CONTAINING POLYMER, AND COPPER-CONTAINING POLYMER FUJIFILM CORPORATION (JP) 2018-04-05 US disclosed
US-20170227690-A1 NEAR INFRARED RAY ABSORBENT COMPOSITION, NEAR INFRARED RAY CUT FILTER, SOLID IMAGE PICKUP ELEMENT, AND CAMERA MODULE FUJIFILM CORPORATION (JP) 2017-08-10 US disclosed
US-20160304730-A1 NEAR INFRARED RADIATION-ABSORBING COMPOSITION, NEAR INFRARED RADIATION CUT-OFF FILTER AND PRODUCTION METHOD THEREFOR, AND CAMERA MODULE AND PRODUCTION METHOD THEREFOR FUJIFILM CORPORATION (JP) 2016-10-20 US disclosed
WO-2015095406-A1 MODIFIED THERAPEUTIC AGENTS, STAPLED PEPTIDE LIPID CONJUGATES, AND COMPOSITIONS THEREOF THE CALIFORNIA INSTITUTE FOR BIOMEDICAL RESEARCH (US) 2015-06-25 WO disclosed
US-20140243322-A1 BIVALENT BROMODOMAIN LIGANDS, AND METHODS OF USING SAME COFERON, INC. (US) 2014-08-28 US disclosed
US-20140243322-A1 BIVALENT BROMODOMAIN LIGANDS, AND METHODS OF USING SAME COFERON, INC. (US) 2014-08-28 US disclosed
WO-2013033268-A2 BIVALENT BROMODOMAIN LIGANDS, AND METHODS OF USING SAME COFERON, INC. (US) 2013-03-07 WO disclosed
US-7790025-B2 External gradient chromatofocusing CRYOBIOPHYSICA, INC. (US) 2010-09-07 US disclosed
US-20070144973-A1 External gradient chromatofocusing CRYOBIOPHYSICA, INC. (US) 2007-06-28 US disclosed
EP-1628729-A2 EXTERNAL GRADIENT CHROMATOFOCUSING Cryobiophysica, Inc. (US) 2006-03-01 EP disclosed
WO-2004103519-A2 EXTERNAL GRADIENT CHROMATOFOCUSING CRYOBIOPHYSICA, INC. (US) 2004-12-02 WO disclosed
US-5037883-A Hydroxypropylmethacrylamide polymer with peptide side chains to which are attached drugs for delivery to target cells CESKOSLOVENSKA AKADEMIE VED (CS) 1991-08-06 US disclosed
EP-0187547-B1 SYNTHETIC POLYMERIC DRUGS Ceskoslovenska akademie ved (CS) 1991-02-27 EP disclosed
EP-0187547-A2 Synthetic polymeric drugs Ceskoslovenska akademie ved (CS) 1986-07-16 EP 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 (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-20140243322-A1 BIVALENT BROMODOMAIN LIGANDS, AND METHODS OF USING SAME BRDT, BRD2, BRD4 CA2 3216/4885CA1 3444/4885ALDH1A1 4558/4885
US-20170227690-A1 NEAR INFRARED RAY ABSORBENT COMPOSITION, NEAR INFRARED RAY CUT FILTER, SOLID IMAGE PICKUP ELEMENT, AND CAMERA MODULE C9, SET, CRY1 CA2 3520/4885CA1 573/4885ALDH1A1 2313/4885

“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.