SCHEMBL24470880

SCHEMBL24470880

CCOC(=O)c1c(C)oc2ccc(O)c(F)c12

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.64
LMNA P02545 3/20 0.58
MAPT P10636 4/20 0.53
HSD17B10 Q99714 2/20 0.53
ALOX15 P16050 1/20 0.53
NPC1 O15118 3/20 0.50
RECQL P46063 2/20 0.50
RAB9A P51151 2/20 0.50
MITF O75030 1/20 0.50
TP53 P04637 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
CA12 O43570 1/20 0.49
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
CA7 P43166 1/20 0.49
CA9 Q16790 1/20 0.49
CA14 Q9ULX7 1/20 0.49
KDM4E B2RXH2 3/20 0.48
MAPK1 P28482 2/20 0.48

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
SCHEMBL29630224 1.00 TSHR (0.64) TSHRLMNAMAPTHSD17B10ALOX15
SCHEMBL11822916 0.83 TSHR (0.64) TSHRLMNAMAPTHSD17B10ALOX15
SCHEMBL24470696 0.83 TSHR (0.67) TSHRLMNAMAPTHSD17B10ALOX15
SCHEMBL253511 0.82 GAA (0.53) TSHRLMNAMAPTSMN1; SMN2NPSR1
SCHEMBL9948375 0.80 MEN1 (0.51) TSHRLMNAMAPTSMN1; SMN2NPSR1
SCHEMBL24470685 0.80 TSHR (0.60) TSHRLMNAMAPTHSD17B10ALOX15
SCHEMBL17918886 0.79 MAPT (0.65) TSHRLMNAMAPTHSD17B10ALOX15
SCHEMBL24470885 0.76 CASP3 (0.50) TSHRLMNAKDM4EMAPK1L3MBTL1
SCHEMBL30569429 0.76 CASP3 (0.50) TSHRLMNAKDM4EMAPK1L3MBTL1
SCHEMBL7825883 0.73 MAPT (0.55) TSHRLMNAMAPTHSD17B10ALOX15

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
CN-116761796-A Aryl derivatives for the treatment of TRPM3 mediated disorders 勒芬天主教大学 2023-09-15 CN disclosed
CN-116745283-A Heterocyclic derivatives for the treatment of TRPM3 mediated disorders 勒芬天主教大学 2023-09-12 CN disclosed
WO-2022112345-A1 ARYL DERIVATIVES FOR TREATING TRPM3 MEDIATED DISORDERS KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2022-06-02 WO disclosed
WO-2022112352-A1 HETEROCYCLE DERIVATIVES FOR TREATING TRPM3 MEDIATED DISORDERS KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2022-06-02 WO disclosed