SCHEMBL24136190

SCHEMBL24136190

COc1ccc(F)c2[nH]c(Cl)cc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.41
KDM4E B2RXH2 1/20 0.41
IDO1 P14902 3/20 0.39
TDO2 P48775 3/20 0.39
NQO1 P15559 1/20 0.36
TUBB1 Q9H4B7 3/20 0.36
TUBB4A P04350 2/20 0.36
TUBB P07437 2/20 0.36
TUBA3C P0DPH7 2/20 0.36
TUBA1B P68363 2/20 0.36
TUBA4A P68366 2/20 0.36
TUBB4B P68371 2/20 0.36
TUBB3 Q13509 2/20 0.36
TUBB2A Q13885 2/20 0.36
TUBB8 Q3ZCM7 2/20 0.36
TUBA3E Q6PEY2 2/20 0.36
TUBA1A Q71U36 2/20 0.36
TUBA1C Q9BQE3 2/20 0.36
TUBB6 Q9BUF5 2/20 0.36
TUBB2B Q9BVA1 2/20 0.36

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
SCHEMBL24136182 0.82 KDM4E (0.44) HPGDKDM4ENQO1TUBB1TUBB4A
SCHEMBL22407908 0.81 KDM4E (0.42) HPGDKDM4EIDO1TDO2NQO1
SCHEMBL24136219 0.77 ADRA2A (0.38) KDM4EIDO1TDO2ALDH1A1CYP1A2
SCHEMBL24136220 0.76 IDO1 (0.36) KDM4EIDO1TDO2ALDH1A1TSHR
SCHEMBL29952109 0.76 HPGD (0.42) HPGDKDM4EIDO1TDO2TUBB1
SCHEMBL20504720 0.76 IMPDH2 (0.39) HPGDKDM4EIDO1TDO2NQO1
SCHEMBL25812174 0.74 KDM4E (0.59) HPGDKDM4EIDO1TDO2TUBB1
SCHEMBL1144985 0.74 KDM4E (0.77) HPGDKDM4EIDO1TDO2TUBB1
SCHEMBL20505200 0.73 KDM4E (0.57) HPGDKDM4EIDO1TDO2TUBB1
SCHEMBL30310687 0.73 KDM4E (0.57) HPGDKDM4EIDO1TDO2TUBB1

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-3928836-A1 N-SUBSTITUTED INDOLE DERIVATIVES AS PGE2 RECEPTOR MODULATORS Idorsia Pharmaceuticals Ltd (CH) 2021-12-29 EP disclosed