SCHEMBL11370942

SCHEMBL11370942

CC(O)(c1cccc(C(F)(F)F)c1)c1cc(Cl)ccc1O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ P2RX1 P51575 8/20 0.47
▸ TMPRSS4 Q9NRS4 5/20 0.47
▸ P2RX4 Q99571 2/20 0.47
▸ P2RX7 Q99572 2/20 0.47
▸ SLC2A1 P11166 1/20 0.47
▸ NTRK1 P04629 1/20 0.46
▸ CDK19 Q9BWU1 1/20 0.46
▸ CYP19A1 P11511 1/20 0.43
▸ MEN1 O00255 3/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ IKBKB O14920 1/20 0.41
▸ CHUK O15111 1/20 0.41
▸ KDR P35968 1/20 0.41
▸ FLT3 P36888 1/20 0.41
▸ MYLK Q15746 1/20 0.41
▸ MAP4K5 Q9Y4K4 1/20 0.41
▸ MAPT P10636 3/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ CYP1A2 P05177 2/20 0.40
▸ CYP3A4 P08684 2/20 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
SCHEMBL11366071 0.88 P2RX1 (0.42) P2RX1TMPRSS4P2RX4P2RX7SLC2A1
SCHEMBL11370625 0.83 HSP90AA1 (0.50) P2RX1TMPRSS4CYP19A1MEN1KMT2A
SCHEMBL17894223 0.80 MEN1 (0.62) CYP19A1MEN1KMT2AMAPTALDH1A1
SCHEMBL19640219 0.80 MEN1 (0.62) CYP19A1MEN1KMT2AMAPTALDH1A1
SCHEMBL17894224 0.80 MEN1 (0.62) CYP19A1MEN1KMT2AMAPTALDH1A1
SCHEMBL11380402 0.79 MEN1 (0.61) MEN1KMT2AMAPTALDH1A1CYP3A4
SCHEMBL1116804 0.73 HSD17B10 (0.50) P2RX1TMPRSS4P2RX4P2RX7MEN1
SCHEMBL19130784 0.72 TSHR (0.50) MEN1KMT2AMAPTALDH1A1CYP3A4
SCHEMBL19124474 0.72 TSHR (0.50) MEN1KMT2AMAPTALDH1A1CYP3A4
SCHEMBL818330 0.71 HSD17B10 (0.48) MEN1KMT2AMAPTALDH1A1CYP3A4

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
US-4281012-A HYPOLIPEMIC ACTIVITY ROUSSEL UCLAF (FR) 1981-07-28 — — US disclosed
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