Gossypol

Gossypol

SCHEMBL11156705

Cc1cc2c(C(C)C)c(O)c(O)c(C=O)c2c(O)c1-c1c(C)cc2c(C(C)C)c(O)c(O)c(C=O)c2c1O.O=CO

nearest known ligand 0.94

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 12/20 0.94
BCL2 P10415 11/20 0.94
AKR1B1 P15121 5/20 0.94
KDM4E B2RXH2 2/20 0.94
MEN1 O00255 2/20 0.94
NPC1 O15118 2/20 0.94
USP2 O75604 2/20 0.94
ALDH1A1 P00352 2/20 0.94
LMNA P02545 2/20 0.94
POLB P06746 2/20 0.94
GAA P10253 2/20 0.94
MAPT P10636 2/20 0.94
THRB P10828 2/20 0.94
HPGD P15428 2/20 0.94
ALOX12 P18054 2/20 0.94
MAPK1 P28482 2/20 0.94
BLM P54132 2/20 0.94
KMT2A Q03164 2/20 0.94
SMN1; SMN2 Q16637 2/20 0.94
NPSR1 Q6W5P4 2/20 0.94

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
Gossypol SCHEMBL9738017 0.97 MCL1 (1.00) MCL1BCL2AKR1B1KDM4EMEN1
Gossypol SCHEMBL30260519 0.97 MCL1 (1.00) MCL1BCL2AKR1B1KDM4EMEN1
Gossypol SCHEMBL29355719 0.97 MCL1 (1.00) MCL1BCL2AKR1B1KDM4EMEN1
Gossypol SCHEMBL3939 0.97 MCL1 (1.00) MCL1BCL2AKR1B1KDM4EMEN1
Gossypol SCHEMBL29798874 0.97 MCL1 (1.00) MCL1BCL2AKR1B1KDM4EMEN1
Gossypol SCHEMBL23014699 0.96 MCL1 (0.97) MCL1BCL2AKR1B1KDM4EMEN1
Gossypol SCHEMBL28166062 0.96 MCL1 (0.97) MCL1BCL2AKR1B1KDM4EMEN1
Gossypol SCHEMBL27542391 0.96 MCL1 (0.97) MCL1BCL2AKR1B1KDM4EMEN1
Gossypol SCHEMBL28855396 0.96 MCL1 (0.97) MCL1BCL2AKR1B1KDM4EMEN1
Gossypol SCHEMBL27755741 0.96 MCL1 (0.97) MCL1BCL2AKR1B1KDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113336934-B Self-emulsifying polyether amine curing agent and preparation method thereof 虎皇新材料科技集团有限公司 2023-04-14 CN claimed
CN-113336934-A Self-emulsifying polyether amine curing agent and preparation method thereof 虎皇新材料科技集团有限公司 2021-09-03 CN claimed
CN-108450178-B Cotton plant molding aid for improving permeability of cotton field and preparation method thereof 渭南高新区促花王科技有限公司 2020-10-09 CN claimed
US-4381298-A Oral male contraceptive composition COULSON PATRICIA B 1983-04-26 US claimed
CN-113336934-B Self-emulsifying polyether amine curing agent and preparation method thereof 虎皇新材料科技集团有限公司 2023-04-14 CN disclosed
CN-113336934-A Self-emulsifying polyether amine curing agent and preparation method thereof 虎皇新材料科技集团有限公司 2021-09-03 CN disclosed
CN-108450178-B Cotton plant molding aid for improving permeability of cotton field and preparation method thereof 渭南高新区促花王科技有限公司 2020-10-09 CN disclosed
CN-108450178-B Cotton plant molding aid for improving permeability of cotton field and preparation method thereof 渭南高新区促花王科技有限公司 2020-10-09 CN disclosed
CN-100413493-C Application of gossypol and its derivatives in preparation of medicine for treating myeloma INST ZOOLOGY CAS (CN) 2008-08-27 CN disclosed
CN-100378055-C One-step prepn process of acid gossypol derivative with acid and acetone aqua SHANGHAI INST ORGANIC CHEM (CN) 2008-04-02 CN disclosed
CN-1887838-A One-step prepn process of acid gossypol derivative with acid and acetone aqua SHANGHAI INST ORGANIC CHEM (CN) 2007-01-03 CN disclosed
US-4381298-A Oral male contraceptive composition COULSON PATRICIA B 1983-04-26 US disclosed