SCHEMBL3278767

SCHEMBL3278767

O=C(O)NCc1ccc(CCl)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 2/20 0.55
CYP2C19 P33261 2/20 0.55
TSHR P16473 2/20 0.55
CYP1A2 P05177 1/20 0.55
CYP2D6 P10635 1/20 0.55
KMT2A Q03164 4/20 0.50
MEN1 O00255 3/20 0.50
SMN1; SMN2 Q16637 2/20 0.48
CA1 P00915 2/20 0.47
CA2 P00918 2/20 0.47
RAB9A P51151 3/20 0.46
ALDH1A1 P00352 2/20 0.46
POLB P06746 1/20 0.46
MAPT P10636 1/20 0.46
LMNA P02545 1/20 0.44
APEX1 P27695 1/20 0.44
TPSAB1 Q15661 2/20 0.44
NPC1 O15118 3/20 0.43
TP53 P04637 1/20 0.43
HPGD P15428 1/20 0.43

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
SCHEMBL11533429 0.89 CYP2C9 (0.65) CYP2C9CYP2C19TSHRCYP1A2CYP2D6
SCHEMBL167573 0.83 MEN1 (0.73) CYP2C9CYP2C19TSHRCYP1A2CYP2D6
SCHEMBL8602062 0.82 CYP2C9 (0.59) CYP2C9CYP2C19TSHRCYP1A2CYP2D6
SCHEMBL5987795 0.81 MAPT (0.68) CYP2C9CYP2C19KMT2AMEN1SMN1; SMN2
SCHEMBL31160290 0.80 TSHR (0.58) CYP2C9CYP2C19TSHRCYP1A2CYP2D6
SCHEMBL6656120 0.80 TSHR (0.58) CYP2C9CYP2C19TSHRCYP1A2CYP2D6
SCHEMBL376127 0.80 CYP1A2 (0.57) CYP2C9CYP2C19TSHRCYP1A2CYP2D6
SCHEMBL3457884 0.80 TSHR (0.57) CYP2C9CYP2C19TSHRCYP1A2CYP2D6
SCHEMBL3662909 0.80 SMN1; SMN2 (0.71) CYP2C9CYP2C19TSHRCYP1A2CYP2D6
SCHEMBL258716 0.80 CYP2C9 (0.62) CYP2C9CYP2C19TSHRCYP1A2CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4204808-A1 TARGET ENGAGEMENT ASSAY FOR RAS PROTEINS Promega Corporation (US) 2023-07-05 EP disclosed
CN-109563043-A SUBSTITUTED PYRIDINES AS INHIBITORS OF DNMT1 葛兰素史密斯克莱知识产权发展有限公司 2019-04-02 CN disclosed
US-7700605-B2 2-cyano-pyrimidines and-triazines as cysteine protease inhibitors NOVARTIS AG (CH) 2010-04-20 US disclosed
US-20080214548-A1 2-Cyano-Pyrimidines and-Triazines as Cysteine Protease Inhibitors FLOHR STEFANIE 2008-09-04 US disclosed
CN-101228136-A 2-cyano-pyrimidines and-triazines as cysteine protease inhibitors NOVARTIS AG (CH) 2008-07-23 CN disclosed
EP-1907368-A1 2-CYANO-PYRIMIDINES AND -TRIAZINES AS CYSTEINE PROTEASE INHIBITORS Novartis AG (CH) 2008-04-09 EP disclosed
WO-2007009715-A1 2-CYANO-PYRIMIDINES AND -TRIAZINES AS CYSTEINE PROTEASE INHIBITORS NOVARTIS AG (CH) 2007-01-25 WO 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 (1 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-20080214548-A1 2-Cyano-Pyrimidines and-Triazines as Cysteine Protease Inhibitors USP2, UCHL3, UCHL5 CYP2C9 1884/4885CYP2C19 2052/4885TSHR 3590/4885

“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.