SCHEMBL17197350

SCHEMBL17197350

COc1ccc([N+](=O)[O-])c2c1CN(C(C)=O)C2

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.44
KMT2A Q03164 4/20 0.44
MEN1 O00255 3/20 0.44
MAPT P10636 1/20 0.44
HPGD P15428 1/20 0.43
TXNRD1 Q16881 1/20 0.42
BAZ2B Q9UIF8 1/20 0.42
LMNA P02545 2/20 0.42
CYP1A2 P05177 1/20 0.42
TDP1 Q9NUW8 2/20 0.41
RAB9A P51151 1/20 0.40
KDM4E B2RXH2 2/20 0.40
SIRT6 Q8N6T7 1/20 0.40
POLB P06746 1/20 0.40
CTDSP1 Q9GZU7 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
TTR P02766 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
SCHEMBL17197287 0.89 BAZ2B (0.49) ALDH1A1KMT2AMEN1MAPTHPGD
SCHEMBL17197262 0.79 NOTUM (0.42) ALDH1A1KMT2AMEN1MAPTHPGD
SCHEMBL17197348 0.76 NOTUM (0.41) ALDH1A1HPGDBAZ2BLMNATDP1
SCHEMBL17197344 0.75 KMT2A (0.48) ALDH1A1KMT2AMEN1MAPTLMNA
SCHEMBL7979886 0.75 BAZ2B (0.51) ALDH1A1MAPTHPGDBAZ2BLMNA
SCHEMBL17197560 0.74 SIRT6 (0.49) ALDH1A1KMT2AMEN1MAPTLMNA
SCHEMBL30730949 0.74 KMT2A (0.63) ALDH1A1KMT2AMEN1MAPTTXNRD1
SCHEMBL6273233 0.74 KMT2A (0.63) ALDH1A1KMT2AMEN1MAPTTXNRD1
SCHEMBL17197355 0.73 BAZ2B (0.46) ALDH1A1KMT2AMEN1MAPTHPGD
SCHEMBL2205083 0.70 SIRT6 (0.72) ALDH1A1KMT2AMEN1MAPTLMNA

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 5 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
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 ALDH1A1 2257/4885KMT2A 1228/4885MEN1 3087/4885
US-10300058-B2 Tyrosine kinase inhibitor and uses thereof EGFR, ERBB2, ABL1 ALDH1A1 2257/4885KMT2A 1228/4885MEN1 3087/4885

“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.