SCHEMBL22368698

SCHEMBL22368698

CCCc1c(SF)n(C)c2ccccc12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 10/20 0.52
▸ KDM4E B2RXH2 4/20 0.46
▸ HTT P42858 2/20 0.46
▸ CYP1A2 P05177 2/20 0.46
▸ CYP2D6 P10635 1/20 0.46
▸ SLC2A1 P11166 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ ALDH1A1 P00352 4/20 0.44
▸ TSHR P16473 2/20 0.44
▸ LMNA P02545 1/20 0.44
▸ GPR3 P46089 1/20 0.44
▸ HPGD P15428 3/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ SRC P12931 7/20 0.41
▸ GAA P10253 1/20 0.40
▸ GLA P06280 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ CREBBP Q92793 1/20 0.38

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
SCHEMBL19538924 0.75 GPR3 (0.56) EGFRKDM4EHTTCYP1A2CYP2D6
SCHEMBL10235160 0.75 ALDH1A1 (0.66) EGFRKDM4EHTTCYP1A2CYP2D6
SCHEMBL19539157 0.74 KDM4E (0.60) EGFRKDM4EHTTCYP1A2CYP2D6
SCHEMBL17673147 0.74 KDM4E (0.49) EGFRKDM4EHTTCYP1A2CYP2D6
SCHEMBL19531696 0.71 KDM4E (0.47) EGFRKDM4EHTTCYP1A2CYP2D6
SCHEMBL1240359 0.69 ALDH1A1 (0.47) EGFRKDM4EHTTCYP1A2CYP2D6
SCHEMBL18730762 0.69 KDM4E (0.44) EGFRKDM4EHTTCYP1A2CYP2D6
SCHEMBL797469 0.66 KDM4E (0.67) KDM4EHTTCYP1A2CYP2D6SLC2A1
SCHEMBL1925036 0.66 GPR3 (0.58) EGFRKDM4EHTTSMN1; SMN2ALDH1A1
SCHEMBL7710952 0.66 KDM4E (0.58) EGFRKDM4EHTTCYP1A2CYP2D6

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-3204360-B1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH INC (US) 2020-08-26 — — EP disclosed
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