SCHEMBL10501599

SCHEMBL10501599

CCCCCCCc1ccc(-c2ncc(-c3ncc(CCCCCC)cn3)cn2)cc1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.74
▸ RAB9A P51151 4/20 0.74
▸ SMN1; SMN2 Q16637 3/20 0.74
▸ ALDH1A1 P00352 3/20 0.74
▸ HSD17B10 Q99714 3/20 0.74
▸ MEN1 O00255 2/20 0.74
▸ KMT2A Q03164 2/20 0.74
▸ KDM4E B2RXH2 2/20 0.74
▸ USP2 O75604 1/20 0.74
▸ GAA P10253 1/20 0.74
▸ HPGD P15428 1/20 0.74
▸ RARB P10826 6/20 0.68
▸ NPC1 O15118 2/20 0.54
▸ STAT3 P40763 1/20 0.54
▸ ATM Q13315 1/20 0.54
▸ RARA P10276 1/20 0.51
▸ MTOR P42345 1/20 0.51
▸ NFKB1 P19838 1/20 0.50
▸ NFKB2 Q00653 1/20 0.50
▸ RELA Q04206 1/20 0.50

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
SCHEMBL10500496 1.00 MAPT (0.74) MAPTRAB9ASMN1; SMN2ALDH1A1HSD17B10
SCHEMBL10500673 1.00 MAPT (0.74) MAPTRAB9ASMN1; SMN2ALDH1A1HSD17B10
SCHEMBL10501426 0.97 MAPT (0.70) MAPTRAB9ASMN1; SMN2ALDH1A1HSD17B10
SCHEMBL10501582 0.97 MAPT (0.70) MAPTRAB9ASMN1; SMN2ALDH1A1HSD17B10
SCHEMBL9723153 0.97 MAPT (0.79) MAPTRAB9ASMN1; SMN2ALDH1A1HSD17B10
SCHEMBL9850122 0.97 MAPT (0.79) MAPTRAB9ASMN1; SMN2ALDH1A1HSD17B10
SCHEMBL9850179 0.97 MAPT (0.79) MAPTRAB9ASMN1; SMN2ALDH1A1HSD17B10
SCHEMBL9850258 0.97 MAPT (0.79) MAPTRAB9ASMN1; SMN2ALDH1A1HSD17B10
SCHEMBL10482122 0.97 MAPT (0.79) MAPTRAB9ASMN1; SMN2ALDH1A1HSD17B10
SCHEMBL9850155 0.97 MAPT (0.79) MAPTRAB9ASMN1; SMN2ALDH1A1HSD17B10

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
EP-0160790-B1 BIPYRIMIDINYL DERIVATIVES AND LIQUID CRYSTAL COMPOSITIONS CONTAINING THEM Chisso Corporation (JP) 1989-08-16 — — EP disclosed
US-4609485-A LIQUID CRYSTALS CHISSO CORPORATION (JP) 1986-09-02 — — US disclosed
EP-0160790-A2 Bipyrimidinyl derivatives and liquid crystal compositions containing them Chisso Corporation (JP) 1985-11-13 — — EP disclosed
Send feedback