SCHEMBL11074384

SCHEMBL11074384

COC(=O)c1ccccc1C(=O)NN(C)C(=S)Nc1cccc(F)c1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.48
MEN1 O00255 5/20 0.47
KMT2A Q03164 5/20 0.47
NPC1 O15118 3/20 0.47
RAB9A P51151 3/20 0.47
MAPT P10636 1/20 0.47
KDM4E B2RXH2 2/20 0.45
PKM P14618 1/20 0.45
HTT P42858 1/20 0.44
HPGD P15428 1/20 0.44
LMNA P02545 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
TSHR P16473 1/20 0.41
ATM Q13315 1/20 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
SCHEMBL11365665 0.88 MEN1 (0.49) GAAMEN1KMT2ANPC1RAB9A
SCHEMBL11063142 0.87 KMT2A (0.47) GAAMEN1KMT2ANPC1RAB9A
SCHEMBL11063878 0.83 HTT (0.46) GAAMEN1KMT2ANPC1RAB9A
SCHEMBL11074428 0.75 ALDH1A1 (0.47) GAAKMT2ANPC1RAB9AMAPT
SCHEMBL11067057 0.75 ALDH1A1 (0.58) MEN1KMT2AHTTHPGDTSHR
Ammonia Solution, Strong SCHEMBL11230292 0.74 ALDH1A1 (0.57) MEN1KMT2AHTTHPGDTSHR
Ammonia Solution, Strong SCHEMBL11230287 0.74 ALDH1A1 (0.57) MEN1KMT2AHTTHPGDTSHR
SCHEMBL11244383 0.74 ALDH1A1 (0.57) MEN1KMT2AHTTHPGDTSHR
SCHEMBL11063673 0.73 MASP2 (0.44) GAAMEN1KMT2ARAB9AMAPT
SCHEMBL11185293 0.73 ALDH1A1 (0.45) GAAMEN1KMT2ANPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4462821-A 1-BENZOYL-3-THIOSEMICARBAZIDFES GULF OIL CORPORATION (US) 1984-07-31 US disclosed
EP-0009324-B1 SUBSTITUTED 1-BENZOYL-3-THIOSEMICARBAZIDES, THEIR MANUFACTURE AND USE AS PLANT GROWTH REGULANTS, AND AGRICULTURAL FORMULATIONS COMPRISING THEM Gulf Oil Corporation (US) 1982-07-21 EP disclosed
US-4282031-A Substituted thiosemicarbazides, their manufacture and use as plant growth regulants GULF OIL CORPORATION (US) 1981-08-04 US disclosed
EP-0009324-A1 Substituted 1-benzoyl-3-thiosemicarbazides, their manufacture and use as plant growth regulants, and agricultural formulations comprising them Gulf Oil Corporation (US) 1980-04-02 EP disclosed