SCHEMBL17197288

SCHEMBL17197288

COc1ccc(N)c2c1CN(C(C)=O)CC2

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 2/20 0.46
BAZ2B Q9UIF8 4/20 0.43
MAPT P10636 4/20 0.41
LMNA P02545 1/20 0.40
CREBBP Q92793 4/20 0.40
BRD4 O60885 2/20 0.40
QDPR P09417 1/20 0.40
KDR P35968 1/20 0.39
ABHD6 Q9BV23 1/20 0.39
BPTF Q12830 1/20 0.39
MAPK1 P28482 1/20 0.39
EP300 Q09472 2/20 0.38
POLB P06746 1/20 0.38
ALDH1A1 P00352 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
PTGDR2 Q9Y5Y4 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
SCHEMBL17197348 0.88 NOTUM (0.41) NOTUMBAZ2BLMNAQDPRABHD6
SCHEMBL17197287 0.79 BAZ2B (0.49) NOTUMBAZ2BMAPTLMNAALDH1A1
SCHEMBL17197369 0.77 DRD1 (0.45)
SCHEMBL17197266 0.76 NOTUM (0.48) NOTUMBAZ2BMAPTLMNACREBBP
SCHEMBL17197268 0.76 NOTUM (0.48) NOTUMBAZ2BMAPTLMNACREBBP
SCHEMBL14067047 0.75 NOTUM (0.58) NOTUMBAZ2BCREBBPABHD6EP300
SCHEMBL7007674 0.75 ABHD6 (0.64) NOTUMABHD6
SCHEMBL11746051 0.74 NOTUM (0.49) NOTUMBAZ2BLMNAQDPRABHD6
SCHEMBL14287493 0.72 NOTUM (0.47) NOTUMBAZ2BMAPTLMNACREBBP
SCHEMBL2252826 0.72 NOTUM (0.61) NOTUMBAZ2BMAPTLMNACREBBP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10300058-B2 Tyrosine kinase inhibitor and uses thereof Xuanzhu Pharma Co., Ltd. (CN) 2019-05-28 US disclosed
US-10300058-B2 Tyrosine kinase inhibitor and uses thereof Xuanzhu Pharma Co., Ltd. (CN) 2019-05-28 US disclosed
US-20170112833-A1 Tyrosine Kinase Inhibitor And Uses Thereof Xuanzhu Pharma Co., Ltd. (CN) 2017-04-27 US disclosed
US-20170112833-A1 Tyrosine Kinase Inhibitor And Uses Thereof Xuanzhu Pharma Co., Ltd. (CN) 2017-04-27 US disclosed
US-20170112833-A1 Tyrosine Kinase Inhibitor And Uses Thereof Xuanzhu Pharma Co., Ltd. (CN) 2017-04-27 US disclosed
WO-2015158310-A1 TYROSINE KINASE INHIBITOR AND USES THEREOF 山东轩竹医药科技有限公司 2015-10-22 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 (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-20170112833-A1 Tyrosine Kinase Inhibitor And Uses Thereof EGFR, ERBB2, ABL1 NOTUM 652/4885BAZ2B 2150/4885MAPT 2077/4885
US-10300058-B2 Tyrosine kinase inhibitor and uses thereof EGFR, ERBB2, ABL1 NOTUM 652/4885BAZ2B 2150/4885MAPT 2077/4885

“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.