SCHEMBL9564259

SCHEMBL9564259

CCC(Cl)c1ccc(NCC(=O)O)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.37
TSHR P16473 2/20 0.37
CRHBP P24387 2/20 0.37
CRHR2 Q13324 2/20 0.37
FFAR1 O14842 1/20 0.37
CDC25A P30304 1/20 0.36
RAB9A P51151 2/20 0.36
NPC1 O15118 1/20 0.36
HPGD P15428 1/20 0.36
AGTR1 P30556 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NPSR1 Q6W5P4 1/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
POLB P06746 1/20 0.34
LMNA P02545 1/20 0.34
MAPT P10636 1/20 0.34
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34

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
SCHEMBL71574 0.79 CA12 (0.49) ALDH1A1CRHBPCRHR2RAB9ANPC1
SCHEMBL5692310 0.78 ALDH1A1 (0.44) ALDH1A1FFAR1CDC25ARAB9ANPC1
SCHEMBL9512454 0.76 ACP3 (0.38)
SCHEMBL28670574 0.76 LMNA (0.50) ALDH1A1FFAR1RAB9ANPC1HPGD
SCHEMBL5607146 0.73 TDP1 (0.42) ALDH1A1TSHRHPGDSMN1; SMN2LMNA
SCHEMBL10955013 0.73 ALDH1A1 (0.52) ALDH1A1CRHBPCRHR2FFAR1RAB9A
SCHEMBL11388203 0.72 HSD17B10 (0.43) ALDH1A1HPGDMEN1KMT2ACA12
SCHEMBL498570 0.72 ALDH1A1 (0.54) ALDH1A1FFAR1RAB9ANPC1HPGD
SCHEMBL159434 0.72 FFAR1 (0.54) ALDH1A1FFAR1CDC25ARAB9ANPC1
Hydrochloric Acid SCHEMBL11718612 0.72 FFAR1 (0.54) ALDH1A1FFAR1CDC25ARAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0551697-A1 Photoinitiator system and photopolymerizable composition using the same HITACHI CHEMICAL CO., LTD. (JP) 1993-07-21 EP disclosed