SCHEMBL9159682

SCHEMBL9159682

O=C(O)NC(NC(=O)O)(c1ccccc1)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNN4 O15554 3/20 0.45
CYP1A2 P05177 3/20 0.44
HDAC3 O15379 1/20 0.43
HDAC4 P56524 1/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC7 Q8WUI4 1/20 0.43
HDAC2 Q92769 1/20 0.43
HDAC10 Q969S8 1/20 0.43
HDAC11 Q96DB2 1/20 0.43
HDAC8 Q9BY41 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
HDAC9 Q9UKV0 1/20 0.43
HDAC5 Q9UQL6 1/20 0.43
KMT2A Q03164 3/20 0.41
MAPT P10636 2/20 0.41
CYP2C19 P33261 1/20 0.40
HIF1A Q16665 1/20 0.40
KIF11 P52732 3/20 0.38
PTPN1 P18031 1/20 0.38
CYP2D6 P10635 1/20 0.38

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
Hydrochloric Acid SCHEMBL11410463 0.98 KCNN4 (0.43) KCNN4CYP1A2HDAC3HDAC4HDAC1
SCHEMBL28905040 0.86 KCNN4 (0.48) KCNN4HDAC3HDAC4HDAC1HDAC7
SCHEMBL28397741 0.82 KDM4E (0.50) KMT2AMAPTSMN1; SMN2MEN1TSHR
SCHEMBL31358110 0.81 KCNN4 (0.47) KCNN4CYP1A2HDAC3HDAC4HDAC1
SCHEMBL11410462 0.81 CYP1A2 (0.46) KCNN4CYP1A2HDAC3HDAC4HDAC1
SCHEMBL10825012 0.80 KCNN4 (0.48) KCNN4CYP1A2HDAC3HDAC4HDAC1
SCHEMBL29897719 0.78 LMNA (0.46) KCNN4CYP1A2KMT2AMAPTCYP2C19
SCHEMBL11021343 0.78 KCNN4 (0.53) KCNN4CYP1A2HDAC3HDAC4HDAC1
SCHEMBL6392143 0.76 PTPN1 (0.45) KCNN4CYP1A2HDAC3HDAC4HDAC1
SCHEMBL28905042 0.76 HDAC3 (0.50) KCNN4CYP1A2HDAC3HDAC4HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0110732-B1 PROCESS FOR PRODUCING DIPHENYLMETHANE DICARBAMATES Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1987-03-11 EP claimed
EP-0123412-B1 METHOD FOR MANUFACTURE OF DIPHENYLMETHANE DIISOCYANATES Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1986-07-09 EP claimed
EP-0016441-B1 A METHOD FOR THE PREPARATION OF A MIXTURE OF DIPHENYL METHANE DICARBAMATES AND POLYMETHYLENE POLYPHENYL CARBAMATES ATLANTIC RICHFIELD COMPANY (US) 1982-05-12 EP claimed
EP-0014482-B1 PREPARATION OF DIPHENYLMETHANE DICARBAMATES AND POLYMETHYLENE POLYPHENYL CARBAMATES WITH LEWIS ACID CATALYSTS INTERCALATED IN GRAPHITE ATLANTIC RICHFIELD COMPANY (US) 1981-11-25 EP claimed
EP-0410900-B1 Method for the preparation of methylene di(phenylurethane) RHONE POULENC CHIMIE (FR) 1995-03-15 EP disclosed
EP-0406129-B1 Method for the preparation of methylene di(phenylurethane) RHONE POULENC CHIMIE (FR) 1994-11-23 EP disclosed
EP-0410900-A1 Method for the preparation of methylene di(phenylurethane) RHONE-POULENC CHIMIE (FR) 1991-01-30 EP disclosed
EP-0406129-A1 Method for the preparation of methylene di(phenylurethane) RHONE-POULENC CHIMIE (FR) 1991-01-02 EP disclosed
EP-0041613-B1 DERIVATIVES OF ARALKYLANILINE AND HERBICIDES CONTAINING THESE COMPOUNDS BASF Aktiengesellschaft (DE) 1984-02-01 EP disclosed