SCHEMBL7559265

SCHEMBL7559265

CCCC(=O)OC1c2ccccc2Oc2ccccc21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.50
MEN1 O00255 5/20 0.50
TSHR P16473 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
USP2 O75604 1/20 0.49
POLB P06746 1/20 0.47
PKM P14618 1/20 0.47
MAPT P10636 1/20 0.47
L3MBTL1 Q9Y468 2/20 0.45
ATM Q13315 2/20 0.44
LMNA P02545 1/20 0.43
CYP1A2 P05177 1/20 0.43
CHRM2 P08172 1/20 0.43
CYP2D6 P10635 1/20 0.43
CHRM1 P11229 1/20 0.43
KCNH2 Q12809 1/20 0.43
HTT P42858 1/20 0.43
NPC1 O15118 1/20 0.42
MAOA P21397 1/20 0.42

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
SCHEMBL7560340 0.88 KMT2A (0.51) KMT2AMEN1TSHRSMN1; SMN2NPSR1
SCHEMBL21597994 0.88 KMT2A (0.51) KMT2AMEN1TSHRSMN1; SMN2NPSR1
SCHEMBL21597992 0.88 KMT2A (0.51) KMT2AMEN1TSHRSMN1; SMN2NPSR1
SCHEMBL21597995 0.88 KMT2A (0.51) KMT2AMEN1TSHRSMN1; SMN2NPSR1
SCHEMBL27864062 0.82 POLB (0.47) KMT2AMEN1TSHRSMN1; SMN2NPSR1
SCHEMBL21597993 0.82 SOAT2 (0.46) KMT2AMEN1POLBMAPT
SCHEMBL28623536 0.81 KMT2A (0.52) KMT2AMEN1TSHRSMN1; SMN2NPSR1
SCHEMBL7558023 0.80 FAAH (0.46) TSHRLMNA
SCHEMBL27498031 0.79 KMT2A (0.55) KMT2AMEN1TSHRSMN1; SMN2NPSR1
SCHEMBL7555796 0.78 ATM (0.50) KMT2AMEN1TSHRSMN1; SMN2NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0787005-B1 DERMATOLOGICAL COMPOSITIONS CONTAINING BENZOYL PEROXIDE AND A COMPOUND REDUCING SKIN IRRITATION HERMAL KURT HERRMAN GMBH (DE) 2002-03-27 EP disclosed
US-5932228-A ADMINISTERING BENZOYL PEROXIDE AND COMPOUND THAT REDUCES SKIN IRRITATION THE PROCTER & GAMBLE COMPANY (US) 1999-08-03 US disclosed
EP-0787005-A2 DERMATOLOGICAL COMPOSITIONS CONTAINING BENZOYL PEROXIDE AND A COMPOUND REDUCING SKIN IRRITATION THE PROCTER & GAMBLE COMPANY (US) 1997-08-06 EP disclosed
US-5545407-A ANTIACNE AGENTS THE PROCTER & GAMBLE COMPANY (US) 1996-08-13 US disclosed
WO-1996012498-A2 DERMATOLOGICAL COMPOSITIONS CONTAINING BENZOYL PEROXIDE AND A COMPOUND REDUCING SKIN IRRITATION THE PROCTER & GAMBLE COMPANY (US) 1996-05-02 WO disclosed
US-5445823-A Benzoyl peroxide and a compound for reducing skin irritation associated with it THE PROCTER & GAMBLE COMPANY (US) 1995-08-29 US disclosed