SCHEMBL11611675

SCHEMBL11611675

CCCCCCc1ccc(-c2ncc(C(=O)Cl)cn2)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.65
▸ MEN1 O00255 3/20 0.65
▸ KMT2A Q03164 3/20 0.65
▸ RAB9A P51151 3/20 0.65
▸ SMN1; SMN2 Q16637 3/20 0.65
▸ ALDH1A1 P00352 2/20 0.65
▸ KDM4E B2RXH2 1/20 0.65
▸ USP2 O75604 1/20 0.65
▸ GAA P10253 1/20 0.65
▸ HPGD P15428 1/20 0.65
▸ HSD17B10 Q99714 1/20 0.65
▸ RARB P10826 8/20 0.64
▸ RARA P10276 1/20 0.56
▸ MTOR P42345 1/20 0.56
▸ THRA P10827 7/20 0.52
▸ THRB P10828 7/20 0.52
▸ NPC1 O15118 2/20 0.51
▸ NFKB1 P19838 1/20 0.51
▸ NFKB2 Q00653 1/20 0.51
▸ RELA Q04206 1/20 0.51

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
SCHEMBL11612451 1.00 MAPT (0.65) MAPTMEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL9745010 1.00 MAPT (0.65) MAPTMEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL9745034 1.00 MAPT (0.65) MAPTMEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL11612452 0.99 ALDH1A1 (0.62) MAPTMEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL11616491 0.94 ALDH1A1 (0.56) MAPTMEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL9744770 0.89 RARB (0.77) MAPTMEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL9323779 0.89 RARB (0.77) MAPTMEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL6024538 0.89 RARB (0.77) MAPTMEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL7767493 0.89 RARB (0.77) MAPTMEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL9746639 0.89 RARB (0.77) MAPTMEN1KMT2ARAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4066570-A OPTICAL CELLS, NEMATIC MIXTURES, LIQUID CRYSTALS HOFFMAN-LA ROCHE INC. (US) 1978-01-03 — — US disclosed
US-4062798-A NEMATIC CRYSTALS HOFFMANN-LA ROCHE INC. (US) 1977-12-13 — — US disclosed
US-3997536-A LIQUID CRYSTALS HOFFMANN-LA ROCHE INC. (US) 1976-12-14 — — US disclosed
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