SCHEMBL14150735

SCHEMBL14150735

O=C(O)c1ccn(-c2ccc(F)cc2)n1

nearest known ligand 0.64

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.64
L3MBTL1 Q9Y468 2/20 0.50
KDM4E B2RXH2 2/20 0.50
MEN1 O00255 2/20 0.48
ATM Q13315 1/20 0.44
CYP2C9 P11712 1/20 0.44
UBE2N P61088 4/20 0.43
MAPT P10636 1/20 0.43
PPP1CA P62136 1/20 0.43
NOTUM Q6P988 1/20 0.42
ACKR3 P25106 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
SCHEMBL168402 0.84 KMT2A (0.54) KMT2AL3MBTL1KDM4EUBE2NMAPT
SCHEMBL19778587 0.84 KMT2A (0.54) KMT2AL3MBTL1KDM4EUBE2NMAPT
SCHEMBL31031032 0.84 KMT2A (0.45) KMT2AKDM4EMEN1CYP2C9MAPT
SCHEMBL1063920 0.83 CYP2C9 (0.61) KMT2AL3MBTL1KDM4ECYP2C9MAPT
SCHEMBL15754423 0.82 RPA1 (0.50) KMT2AL3MBTL1KDM4EMEN1ATM
SCHEMBL14812729 0.81 KMT2A (0.44) KMT2AMEN1ATMCYP2C9
SCHEMBL2360605 0.81 UBE2N (0.48) KMT2ACYP2C9UBE2NMAPTNOTUM
SCHEMBL15755051 0.80 KEAP1 (0.47) KMT2AMEN1CYP2C9NOTUM
SCHEMBL28291686 0.80 KMT2A (0.50) KMT2AL3MBTL1KDM4EMEN1UBE2N
SCHEMBL1816062 0.80 CYP2C9 (0.45) KMT2AL3MBTL1KDM4ECYP2C9MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103596937-B Substituted benzamide derivatives 霍夫曼-拉罗奇有限公司 2016-06-29 CN claimed
EP-2718271-B1 SUBSTITUTED BENZAMIDE DERIVATIVES HOFFMANN LA ROCHE (CH) 2015-08-12 EP claimed
US-9029370-B2 Substituted benzamide derivatives HOFFMANN-LA ROCHE INC. (US) 2015-05-12 US claimed
EP-2718271-A1 SUBSTITUTED BENZAMIDE DERIVATIVES F.HOFFMANN-LA ROCHE AG (CH) 2014-04-16 EP claimed
WO-2012168265-A1 SUBSTITUTED BENZAMIDE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2012-12-13 WO claimed
US-20120316165-A1 SUBSTITUTED BENZAMIDE DERIVATIVES HOFFMANN-LA ROCHE INC. 2012-12-13 US claimed
US-20240400577-A1 MODULATORS OF PROTEIN KINASES VIBLIOME THERAPEUTICS, LLC 2024-12-05 US disclosed
US-11834452-B2 CXCR7 antagonists CHEMOCENTRYX, INC. (US) 2023-12-05 US disclosed
US-11834452-B2 CXCR7 antagonists CHEMOCENTRYX, INC. (US) 2023-12-05 US disclosed
US-11834452-B2 CXCR7 antagonists CHEMOCENTRYX, INC. (US) 2023-12-05 US disclosed
CN-117143019-A As beta 2 Pyrazole amide derivatives of allosteric antagonists of the adrenergic receptors 常州大学 2023-12-01 CN disclosed
CN-117088861-A 2-substituted aryl-oxazolin-4-one derivative and application thereof 浙江大学 2023-11-21 CN disclosed
WO-2023183444-A1 MODULATORS OF PROTEIN KINASES VIBLIOME THERAPEUTICS, LLC (US) 2023-09-28 WO disclosed
CN-103596937-A Substituted benzamide derivatives HOFFMANN LA ROCHE 2014-02-19 CN disclosed
US-20120316172-A1 PYRAZOLE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2012-12-13 US disclosed
WO-2012168265-A1 SUBSTITUTED BENZAMIDE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2012-12-13 WO disclosed
WO-2012168260-A1 PYRAZOLE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2012-12-13 WO disclosed
US-20120316165-A1 SUBSTITUTED BENZAMIDE DERIVATIVES HOFFMANN-LA ROCHE INC. 2012-12-13 US disclosed
CN-1342147-A Nitrooxyderivatives having anti-inflammatory, analgesic and antithrombotic activity NICOX SA (FR) 2002-03-27 CN disclosed
CN-1050382-A Pyrazole derivatives and preparation method thereof and medicinal compositions FUJISAWA PHARMACEUTICAL CO (JP) 1991-04-03 CN 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 (4 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-20240400577-A1 MODULATORS OF PROTEIN KINASES MAP3K20, PRKCE, PRKCH KMT2A 2661/4885L3MBTL1 2538/4885KDM4E 2695/4885
US-20120316165-A1 SUBSTITUTED BENZAMIDE DERIVATIVES NPY4R, PER2, NPY1R KMT2A 1243/4885L3MBTL1 2952/4885KDM4E 1330/4885
US-20120316172-A1 PYRAZOLE DERIVATIVES TAAR1, TAAR5, NPY1R KMT2A 2339/4885L3MBTL1 3584/4885KDM4E 3125/4885
US-11834452-B2 CXCR7 antagonists CXCR1, CXCR5, CCR7 KMT2A 4596/4885L3MBTL1 4266/4885KDM4E 4537/4885

“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.