SCHEMBL24519726

SCHEMBL24519726

CCCn1c(=O)ccc2cc(NSCc3ccc(C)cc3)ccc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RX3 P56373 2/20 0.41
BRPF1 P55201 5/20 0.39
MAPT P10636 3/20 0.39
LMNA P02545 2/20 0.39
POLB P06746 2/20 0.39
TP53 P04637 1/20 0.36
THRB P10828 1/20 0.36
ADORA2A P29274 2/20 0.34
ADORA2B P29275 2/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
BTK Q06187 1/20 0.34
CCNB2 O95067 1/20 0.33
CCNE2 O96020 1/20 0.33
CDK1 P06493 1/20 0.33
FGFR1 P11362 1/20 0.33
CDK4 P11802 1/20 0.33
CCNB1 P14635 1/20 0.33
CCNA2 P20248 1/20 0.33
FGFR2 P21802 1/20 0.33

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
SCHEMBL20616477 0.79 BRPF1 (0.55) P2RX3BRPF1MAPTLMNAPOLB
SCHEMBL17979387 0.77 MAPT (0.45) BRPF1MAPTPOLBADORA2AADORA2B
SCHEMBL20344771 0.72 TP53 (0.39) P2RX3BRPF1MAPTLMNAPOLB
SCHEMBL17979340 0.71 BRPF1 (0.37) BRPF1MAPTLMNAPOLBCCNB2
SCHEMBL17979482 0.71 BRPF1 (0.41) BRPF1MAPTLMNATP53NPC1
SCHEMBL18571318 0.69 HDAC1 (0.43) MAPTLMNAPOLBTP53NPC1
SCHEMBL20344752 0.68 BRPF1 (0.50) BRPF1MAPTBRD4BRD1BRD9
SCHEMBL20344777 0.68 BRPF1 (0.50) BRPF1MAPTLMNATP53BRD4
SCHEMBL17505180 0.68 BRPF1 (0.63) BRPF1MAPTPOLBADORA2AADORA2B
SCHEMBL20344753 0.68 BRPF1 (0.35) P2RX3BRPF1MAPTLMNAPOLB

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