SCHEMBL25566709

SCHEMBL25566709

C=C1Cc2ccc(N/C(=C\CC)Nc3ccc(C(F)(F)F)c(OC)c3)cc2N1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CSF1R P07333 1/20 0.41
▸ DDR1 Q08345 1/20 0.34
▸ TRPV1 Q8NER1 6/20 0.33
▸ MEN1 O00255 3/20 0.33
▸ KMT2A Q03164 3/20 0.33
▸ EPHX2 P34913 1/20 0.33
▸ HTR2A P28223 1/20 0.33
▸ UTS2R Q9UKP6 2/20 0.33
▸ LMNA P02545 4/20 0.32
▸ MAPT P10636 4/20 0.32
▸ SMN1; SMN2 Q16637 2/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ CYP2C9 P11712 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ BRAF P15056 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ GAA P10253 1/20 0.31

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
SCHEMBL25566713 0.74 CSF1R (0.52) CSF1RDDR1TRPV1MEN1KMT2A
SCHEMBL19411114 0.63 CYP1A2 (0.75) CSF1RMEN1KMT2ALMNAMAPT
SCHEMBL19480627 0.63 CYP2C9 (0.57) CSF1RMEN1KMT2ALMNAMAPT
SCHEMBL13105727 0.61 HTR2A (0.44) CSF1RMEN1KMT2AHTR2AUTS2R
SCHEMBL19957410 0.58 NPSR1 (0.65) MEN1KMT2ALMNAMAPTGAA
SCHEMBL19957442 0.58 NPSR1 (0.51) MEN1KMT2ALMNAMAPTSMN1; SMN2
SCHEMBL25566737 0.58 MAPT (0.51) MEN1KMT2ALMNAMAPTSMN1; SMN2
SCHEMBL1011920 0.58 POLB (0.63) MEN1KMT2ALMNAMAPTSMN1; SMN2
SCHEMBL29277354 0.58 ALDH1A1 (0.43) MEN1KMT2AHTR2ALMNAMAPT
SCHEMBL25566598 0.57 KDR (0.51) CSF1RTRPV1EPHX2BRAF

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
WO-2023078207-A1 6-POSITION-SUBSTITUTED INDOLINONE DERIVATIVE, PREPARATION METHOD THEREFOR, AND MEDICAL USE THEREOF 南京中医药大学 2023-05-11 — — WO disclosed
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