SCHEMBL24925925

SCHEMBL24925925

CC1(N)C=Cc2sc3ccccc3c2C=C1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 1/20 0.38
ROCK1 Q13464 1/20 0.33
ALDH1A1 P00352 3/20 0.33
MAPT P10636 3/20 0.33
RAB9A P51151 2/20 0.33
HPGD P15428 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
LOXL2 Q9Y4K0 1/20 0.32
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
LIMK1 P53667 2/20 0.30
KDM4E B2RXH2 1/20 0.30
GLA P06280 1/20 0.30
GAA P10253 1/20 0.30
ALOX15 P16050 1/20 0.30
ATM Q13315 1/20 0.30
HSD17B10 Q99714 1/20 0.30
IKBKB O14920 1/20 0.30

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
SCHEMBL17528782 0.86 GPR3 (0.40) GPR3ROCK1ALDH1A1MAPTRAB9A
SCHEMBL23589522 0.83 GPR3 (0.38) GPR3ROCK1ALDH1A1MAPTRAB9A
SCHEMBL24795621 0.81 GPR3 (0.35) GPR3ALDH1A1
SCHEMBL6545120 0.76 GPR3 (0.52) GPR3ALDH1A1MAPTRAB9AHPGD
SCHEMBL25056576 0.71
SCHEMBL19299443 0.69 GPR3 (0.40) GPR3ALDH1A1MAPTRAB9AHPGD
SCHEMBL13445703 0.69 GPR3 (0.40) GPR3ALDH1A1MAPTRAB9AHPGD
SCHEMBL19721212 0.68 GPR3 (0.43) GPR3ALDH1A1MAPTRAB9AHPGD
SCHEMBL278665 0.68 GPR3 (0.43) GPR3ALDH1A1MAPTRAB9AHPGD
SCHEMBL12071887 0.66 GPR3 (0.36) GPR3ROCK1ALDH1A1MAPTKDM4E

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-4123738-A1 HIGHLY EFFICIENT AND LONG-LASTING ORGANIC LIGHT-EMITTING DIODE SFC Co., Ltd. (KR) 2023-01-25 EP disclosed