SCHEMBL7738252

SCHEMBL7738252

O=C(O)c1ccc(C(=O)c2ccccc2)cc1.[NaH]

nearest known ligand 0.95

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRD5A2 P31213 7/20 0.95
TSHR P16473 2/20 0.74
DAO P14920 1/20 0.74
NAPRT Q6XQN6 1/20 0.74
ALDH1A1 P00352 1/20 0.74
CES2 O00748 1/20 0.68
CES1 P23141 1/20 0.68
FFAR1 O14842 1/20 0.64
TP53 P04637 1/20 0.63
CYP2C8 P10632 1/20 0.63
CYP2C9 P11712 1/20 0.63
ATM Q13315 1/20 0.61
TDP1 Q9NUW8 1/20 0.61
L3MBTL1 Q9Y468 1/20 0.61
MEN1 O00255 1/20 0.58
LMNA P02545 1/20 0.58
MAPT P10636 1/20 0.58
RAB9A P51151 1/20 0.58
KMT2A Q03164 1/20 0.58
MAPK13 O15264 1/20 0.58

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
SCHEMBL81964 0.97 SRD5A2 (1.00) SRD5A2TSHRDAONAPRTALDH1A1
Benzophenone SCHEMBL12506193 0.97 SRD5A2 (1.00) SRD5A2TSHRDAONAPRTALDH1A1
Hydrochloric Acid SCHEMBL1302150 0.95 SRD5A2 (0.95) SRD5A2TSHRDAONAPRTALDH1A1
Benzophenone SCHEMBL20578106 0.95 SRD5A2 (0.94) SRD5A2TSHRDAONAPRTALDH1A1
Benzophenone SCHEMBL1483016 0.90 SRD5A2 (0.86) SRD5A2TSHRDAONAPRTALDH1A1
Benzoic Acid SCHEMBL11792463 0.89 TSHR (0.93) SRD5A2TSHRDAONAPRTALDH1A1
Benzoic Acid SCHEMBL128630 0.89 TSHR (0.93) SRD5A2TSHRDAONAPRTALDH1A1
Benzoic Acid SCHEMBL10713850 0.89 TSHR (0.93) SRD5A2TSHRDAONAPRTALDH1A1
Benzoic Acid SCHEMBL11799336 0.89 TSHR (0.93) SRD5A2TSHRDAONAPRTALDH1A1
Benzoic Acid SCHEMBL2591453 0.89 TSHR (0.93) SRD5A2TSHRDAONAPRTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6410610-B1 ADIABATICALLY PHOTOPOLYMERIZATION STOCKHAUSEN GMBH & CO. KG (DE) 2002-06-25 US disclosed
CN-1278271-A Method for producing cationic polyelectrolyte STOCKHAUSEN CHEM FAB GMBH (DE) 2000-12-27 CN disclosed