SCHEMBL24519714

SCHEMBL24519714

Cc1ccc(CSCl)cc1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 3/20 0.50
ACHE P22303 4/20 0.44
BCHE P06276 3/20 0.44
RAB9A P51151 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2A6 P11509 1/20 0.42
TAAR1 Q96RJ0 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
HTT P42858 1/20 0.42
AGXT P21549 2/20 0.41
RECQL P46063 2/20 0.40
ALDH1A1 P00352 2/20 0.40
TP53 P04637 1/20 0.40
MAPT P10636 1/20 0.40
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39

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
SCHEMBL11834672 0.86 NOS1 (0.39) IDO1RAB9ACYP1A2ALDH1A1
SCHEMBL915196 0.78 IDO1 (0.54) IDO1ACHERAB9ACYP1A2CYP2A6
SCHEMBL2802287 0.78 IDO1 (0.54) IDO1ACHEBCHERAB9ACYP1A2
SCHEMBL515186 0.76 MAPT (0.56) IDO1ACHEBCHERAB9ACYP1A2
SCHEMBL11239117 0.75 IDO1 (0.47) IDO1ACHEBCHERAB9AHTT
SCHEMBL4260106 0.74 IDO1 (0.50) IDO1ACHEBCHERAB9ACYP1A2
SCHEMBL9976773 0.74 IDO1 (0.50) IDO1ACHEBCHERAB9ACYP1A2
SCHEMBL2468970 0.74 IDO1 (0.56) IDO1ACHEBCHERAB9ACYP1A2
SCHEMBL28430892 0.74 IDO1 (0.52) IDO1ACHEBCHERAB9ACYP1A2
SCHEMBL24330360 0.74 IDO1 (0.50) IDO1ACHEBCHERAB9ACYP1A2

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-3398940-B1 HIGH STRESS RESISTANT PLANT GROWTH REGULATOR AND PREPARATION METHOD AND USE THEREOF CAS CENTER FOR EXCELLENCE IN MOLECULAR PLANT SCIENCES (CN) 2022-06-22 EP disclosed