SCHEMBL6326557

SCHEMBL6326557

COc1cc2c(Cl)nccc2cc1Br

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APAF1 O14727 2/20 0.47
NSD2 O96028 2/20 0.47
CASP3 P42574 2/20 0.47
SENP8 Q96LD8 2/20 0.47
SENP7 Q9BQF6 2/20 0.47
SENP6 Q9GZR1 2/20 0.47
TDP2 O95551 1/20 0.47
PPP1CA P62136 1/20 0.47
SAE1 Q9UBE0 1/20 0.47
UBA2 Q9UBT2 1/20 0.47
TNF P01375 5/20 0.46
PDE10A Q9Y233 3/20 0.43
PDE3B Q13370 2/20 0.43
PDE3A Q14432 2/20 0.43
CYP3A4 P08684 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
USP2 O75604 2/20 0.41
ALDH1A1 P00352 2/20 0.41
LMNA P02545 2/20 0.41
CYP1A2 P05177 2/20 0.41

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
SCHEMBL30853086 1.00 APAF1 (0.47) APAF1NSD2CASP3SENP8SENP7
SCHEMBL628689 0.94 APAF1 (0.47) APAF1NSD2CASP3SENP8SENP7
SCHEMBL5358941 0.86 TNF (0.57) APAF1NSD2CASP3SENP8SENP7
SCHEMBL31589356 0.86 TNF (0.57) APAF1NSD2CASP3SENP8SENP7
SCHEMBL16431495 0.82 APAF1 (0.48) APAF1NSD2CASP3SENP8SENP7
SCHEMBL6768992 0.81 TNF (0.46) APAF1NSD2CASP3SENP8SENP7
SCHEMBL15049245 0.81 NSD2 (0.47) APAF1NSD2CASP3SENP8SENP7
SCHEMBL29728760 0.81 NSD2 (0.47) APAF1NSD2CASP3SENP8SENP7
SCHEMBL17137277 0.80 KMO (0.36) APAF1NSD2CASP3SENP8SENP7
SCHEMBL1536597 0.80 TNF (0.48) APAF1NSD2CASP3SENP8SENP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120035439-A Lactic acid enhancing compounds and uses thereof 格莱制药股份有限公司 2025-05-23 CN disclosed
US-20220298138-A1 ENZYME INHIBITORS SYGNATURE DISCOVERY LIMITED (GB) 2022-09-22 US disclosed
EP-4017586-A1 ENZYME INHIBITORS Kalvista Pharmaceuticals Limited (GB) 2022-06-29 EP disclosed
CN-114269431-A Enzyme inhibitors 卡尔维斯塔制药有限公司 2022-04-01 CN disclosed
WO-2021032933-A1 ENZYME INHIBITORS KALVISTA PHARMACEUTICALS LIMITED (GB) 2021-02-25 WO disclosed
WO-2021032933-A1 ENZYME INHIBITORS KALVISTA PHARMACEUTICALS LIMITED (GB) 2021-02-25 WO disclosed
EP-2793887-B1 SULPHONYLAMINOPYRROLIDINONE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC APPLICATION SANOFI SA (FR) 2015-10-21 EP disclosed
US-9150544-B2 Sulphonylaminopyrrolidinone derivatives, their preparation and their therapeutic application SANOFI (FR) 2015-10-06 US disclosed
US-20140329801-A1 SULPHONYLAMINOPYRROLIDINONE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION SANOFI (FR) 2014-11-06 US disclosed
EP-2793887-A1 SULPHONYLAMINOPYRROLIDINONE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION SANOFI (FR) 2014-10-29 EP disclosed
WO-2013092756-A1 SULPHONYLAMINOPYRROLIDINONE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION SANOFI (FR) 2013-06-27 WO disclosed
EP-2606893-A1 Sulphonylaminopyrrolidinone derivatives, their preparation and their therapeutic application SANOFI (FR) 2013-06-26 EP disclosed
US-20050107409-A1 Aromatic bicyclic compounds, preparation thereof and their use as pharmaceutical compositions BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2005-05-19 US disclosed
WO-2004080970-A1 NOVEL BICYCLIC AROMATIC COMPOUNDS, THE PRODUCTION AND USE THEREOF IN THE FORM OF DRUGS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2004-09-23 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 (3 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-20140329801-A1 SULPHONYLAMINOPYRROLIDINONE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION F9, TFPI, SERPINC1 APAF1 168/4885NSD2 1628/4885CASP3 1077/4885
US-20220298138-A1 ENZYME INHIBITORS SERPINB1, CMA1, MAOB APAF1 653/4885NSD2 2651/4885CASP3 1924/4885
US-20050107409-A1 Aromatic bicyclic compounds, preparation thereof and their use as pharmaceutical compositions F12, F2, F11 APAF1 297/4885NSD2 4307/4885CASP3 694/4885

“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.