SCHEMBL16396109

SCHEMBL16396109

COC(=O)c1cc2cc([N+](=O)[O-])c(Br)cc2s1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN2 P17706 4/20 0.51
HDAC1 Q13547 2/20 0.43
POLB P06746 2/20 0.42
LMNA P02545 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
MAPT P10636 1/20 0.41
HDAC3 O15379 1/20 0.40
HDAC4 P56524 1/20 0.40
HDAC7 Q8WUI4 1/20 0.40
HDAC2 Q92769 1/20 0.40
HDAC10 Q969S8 1/20 0.40
HDAC11 Q96DB2 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
HDAC9 Q9UKV0 1/20 0.40
HDAC5 Q9UQL6 1/20 0.40
USP10 Q14694 1/20 0.40
STING1 Q86WV6 4/20 0.39

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
SCHEMBL31158388 1.00 PTPN2 (0.51) PTPN2HDAC1POLBLMNASMN1; SMN2
SCHEMBL19433701 0.86 PTPN2 (0.51) PTPN2POLBLMNASMN1; SMN2KMT2A
SCHEMBL31158466 0.86 PTPN2 (0.51) PTPN2POLBLMNASMN1; SMN2KMT2A
SCHEMBL28538335 0.86 PTPN2 (0.58) PTPN2POLBLMNASMN1; SMN2KMT2A
SCHEMBL19433565 0.84 LMNA (0.45) PTPN2HDAC1POLBLMNASMN1; SMN2
SCHEMBL16396141 0.84 HDAC3 (0.46) PTPN2HDAC1POLBLMNASMN1; SMN2
SCHEMBL16396006 0.84 PTPN2 (0.45) PTPN2HDAC1POLBLMNASMN1; SMN2
SCHEMBL16396400 0.84 PTPN2 (0.43) PTPN2HDAC1POLBLMNASMN1; SMN2
SCHEMBL29924771 0.81 PTPN2 (0.45) PTPN2HDAC1POLBLMNASMN1; SMN2
SCHEMBL29149728 0.81 PTPN2 (0.45) PTPN2HDAC1POLBLMNASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260125346-A1 Isoquinolinone Derivatives and 4H-Quinolizinone Derivatives and Pharmaceutical Compositions Thereof for the Treatment of Disease BEONE MEDICINES I GMBH (CH) 2026-05-07 US disclosed
EP-3227271-B1 HETEROCYCLIC DERIVATIVES AND USE THEREOF C&C RES LAB (KR) 2025-08-13 EP disclosed
CN-107001345-B Heterocyclic derivatives and use thereof 株式会社C&C新药研究所 2021-03-02 CN disclosed
US-10633394-B2 Heterocyclic derivatives and use thereof C&C RESEARCH LABORATORIES (KR) 2020-04-28 US disclosed
US-10562912-B2 Heterocyclic derivatives and use thereof C&C RESEARCH LABORATORIES (KR) 2020-02-18 US disclosed
US-20190119297-A1 HETEROCYCLIC DERIVATIVES AND USE THEREOF C&C RESEARCH LABORATORIES (KR) 2019-04-25 US disclosed
EP-3004057-B1 HETEROCYCLIC DERIVATIVES AND THEIR USE AS STAT 3 INHIBITORS C&C RES LAB (KR) 2018-07-25 EP disclosed
EP-3227271-A2 HETEROCYCLIC DERIVATIVES AND USE THEREOF C&C Research Laboratories (KR) 2017-10-11 EP disclosed
US-20160108056-A1 HETEROCYCLIC DERIVATIVES AND USE THEREOF C&C RESEARCH LABORATORIES (KR) 2016-04-21 US disclosed
EP-3004057-A1 HETEROCYCLIC DERIVATIVES AND USE THEREOF C&C Research Laboratories (KR) 2016-04-13 EP disclosed
WO-2014196793-A1 HETEROCYCLIC DERIVATIVES AND USE THEREOF C&C RESEARCH LABORATORIES (KR) 2014-12-11 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 (5 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-10633394-B2 Heterocyclic derivatives and use thereof STAT3, JAK2, STAT5A PTPN2 329/4885HDAC1 144/4885POLB 4570/4885
US-20160108056-A1 HETEROCYCLIC DERIVATIVES AND USE THEREOF STAT3, JAK2, STAT5A PTPN2 329/4885HDAC1 144/4885POLB 4570/4885
US-10562912-B2 Heterocyclic derivatives and use thereof STAT3, JAK2, STAT5A PTPN2 329/4885HDAC1 144/4885POLB 4570/4885
US-20260125346-A1 Isoquinolinone Derivatives and 4H-Quinolizinone Derivatives and Pharmaceutical Compositions Thereof for the Treatment of Disease NR3C1, NR3C2, PIK3R4 PTPN2 811/4885HDAC1 236/4885POLB 1081/4885
US-20190119297-A1 HETEROCYCLIC DERIVATIVES AND USE THEREOF STAT3, JAK2, STAT5A PTPN2 329/4885HDAC1 144/4885POLB 4570/4885

“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.