SCHEMBL11672341

SCHEMBL11672341

Cc1ccc(C)c(C(=O)CN(C)c2ccccc2)c1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 4/20 0.54
▸ KMT2A Q03164 4/20 0.54
▸ RXFP1 Q9HBX9 1/20 0.45
▸ TSHR P16473 1/20 0.44
▸ MAPT P10636 3/20 0.42
▸ CYP3A4 P08684 2/20 0.42
▸ CYP2D6 P10635 2/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ POLB P06746 3/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ HSD11B1 P28845 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40

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
SCHEMBL11670526 0.82 MEN1 (0.51) MEN1KMT2ATSHRMAPTCYP3A4
SCHEMBL23271325 0.79 RXFP1 (0.49) MEN1KMT2ARXFP1MAPTALDH1A1
SCHEMBL11671426 0.78 MEN1 (0.47) MEN1KMT2ATSHRMAPTCYP3A4
SCHEMBL11671631 0.78 KMT2A (0.58) MEN1KMT2ARXFP1MAPTCYP3A4
SCHEMBL20541420 0.75 NPC1 (0.44) MEN1KMT2ARXFP1MAPTCYP3A4
SCHEMBL11671553 0.74 CYP3A4 (0.46) MEN1KMT2AMAPTCYP3A4NPC1
SCHEMBL6203162 0.73 ALDH1A1 (0.55) MEN1KMT2ARXFP1MAPTCYP3A4
SCHEMBL11673395 0.73 MEN1 (0.51) MEN1KMT2ATSHRCYP3A4CYP2D6
SCHEMBL269145 0.73 MEN1 (0.66) MEN1KMT2ATSHRMAPTCYP3A4
SCHEMBL11672345 0.73 KMT2A (0.47) MEN1KMT2AMAPTCYP3A4NPC1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4039526-A PRINTING, POLYACRYLONITRILE, POLYESTERS, POLYAMIDES BAYER AKTIENGESELLSCHAFT (DT) 1977-08-02 — — US disclosed
US-4039539-A 1,2,4-Triazole-azo-aniline cationic dyestuffs BAYER AKTIENGESELLSCHAFT (DT) 1977-08-02 — — US disclosed
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