SCHEMBL10130241

SCHEMBL10130241

Cc1cc2c(C)c(O)c(O)cc2c(O)c1-c1c(C)cc2c(C)c(O)c(O)cc2c1O

nearest known ligand 0.61

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
BCL2L1 Q07817 19/20 0.61
BCL2 P10415 11/20 0.61
MCL1 Q07820 11/20 0.61
BCL2L2 Q92843 1/20 0.61
BCL2A1 Q16548 8/20 0.50
LDHA P00338 1/20 0.41
LDHB P07195 1/20 0.41
BAK1 Q16611 2/20 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
SCHEMBL13018809 0.76 BCL2L1 (0.55) BCL2L1BCL2MCL1BCL2L2BCL2A1
SCHEMBL2622283 0.76 BCL2L1 (0.60) BCL2L1BCL2MCL1BCL2L2BCL2A1
Apogossypol SCHEMBL2513478 0.76 BCL2L1 (1.00) BCL2L1BCL2MCL1BCL2L2BCL2A1
Apogossypol SCHEMBL29467534 0.76 BCL2L1 (1.00) BCL2L1BCL2MCL1BCL2L2BCL2A1
Apogossypol SCHEMBL29353524 0.76 BCL2L1 (1.00) BCL2L1BCL2MCL1BCL2L2BCL2A1
SCHEMBL14995971 0.76 BCL2L1 (0.59) BCL2L1BCL2MCL1BCL2L2BCL2A1
SCHEMBL14995996 0.76 SMN1; SMN2 (0.41) BCL2L1BCL2MCL1BCL2L2BCL2A1
SCHEMBL14958609 0.75 MCL1 (0.87) BCL2L1BCL2MCL1BCL2L2BCL2A1
SCHEMBL354203 0.75 BCL2L1 (0.69) BCL2L1BCL2MCL1BCL2L2BCL2A1
SCHEMBL10130333 0.75 BCL2L1 (0.42) BCL2L1BCL2MCL1BCL2L2BCL2A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8937193-B2 Apogossypolone derivatives as anticancer agents SANFORD-BURNHAM MEDICAL RESEARCH INSTITUTE (US) 2015-01-20 US disclosed
US-8455540-B2 Gossypol and apogossypol derivatives, preparation thereof and uses thereof UNIVERSITE DU MAINE (LE MANS) (FR) 2013-06-04 US disclosed
US-8455540-B2 Gossypol and apogossypol derivatives, preparation thereof and uses thereof UNIVERSITE DU MAINE (LE MANS) (FR) 2013-06-04 US disclosed
US-8436207-B2 Naphthalene-based inhibitors of anti-apoptotic proteins BURNHAM INSTITUTE FOR MEDICAL RESEARCH (US) 2013-05-07 US disclosed
US-20120015992-A1 Napthalene-Based Inhibitors of Anti-Apoptotic Proteins BURNHAM INSTITUTE FOR MEDICAL RESEARCH (US) 2012-01-19 US disclosed
US-8039668-B2 Naphthalene-based inhibitors of anti-apoptotic proteins BURNHAM INSTITUTE FOR MEDICAL RESEARCH (US) 2011-10-18 US disclosed
US-20110112112-A1 APOGOSSYPOLONE DERIVATIVES AS ANTICANCER AGENTS SANFORD-BURNHAM MEDICAL RESEARCH INSTITUTE (US) 2011-05-12 US disclosed
US-20100331398-A1 DERIVES DU GOSSYPOL ET DE L'APOGOSSYPOL, LEURS PREPARATIONS ET LEURS APPLICTIONS UNIVERSITE DU MAINE (LE MANS) (FR) 2010-12-30 US disclosed
US-20100331398-A1 DERIVES DU GOSSYPOL ET DE L'APOGOSSYPOL, LEURS PREPARATIONS ET LEURS APPLICTIONS UNIVERSITE DU MAINE (LE MANS) (FR) 2010-12-30 US disclosed
WO-2010120943-A1 NAPHTHALENE-BASED INHIBITORS OF ANTI-APOPTOTIC PROTEINS SANFORD-BURNHAM MEDICAL RESEARCH INSTITUTE (US) 2010-10-21 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-20110112112-A1 APOGOSSYPOLONE DERIVATIVES AS ANTICANCER AGENTS CYP17A1, HSD17B7, CYP27A1 BCL2L1 195/4885BCL2 142/4885MCL1 34/4885
US-20120015992-A1 Napthalene-Based Inhibitors of Anti-Apoptotic Proteins HAX1, PRDX1, APOL1 BCL2L1 49/4885BCL2 30/4885MCL1 629/4885
US-20100331398-A1 DERIVES DU GOSSYPOL ET DE L'APOGOSSYPOL, LEURS PREPARATIONS ET LEURS APPLICTIONS LSS, GRHPR, NR1H3 BCL2L1 1749/4885BCL2 3236/4885MCL1 3714/4885

“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.