SCHEMBL11229908

SCHEMBL11229908

CCCCCCCCCc1ccc(-c2nnc(-c3ccc(CCCCCCCCC)cc3)nn2)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.65
▸ HSD17B10 Q99714 3/20 0.65
▸ KDM4E B2RXH2 3/20 0.65
▸ MEN1 O00255 2/20 0.65
▸ MAPT P10636 2/20 0.65
▸ KMT2A Q03164 2/20 0.65
▸ RAB9A P51151 2/20 0.65
▸ USP2 O75604 1/20 0.65
▸ GAA P10253 1/20 0.65
▸ HPGD P15428 1/20 0.65
▸ SMN1; SMN2 Q16637 1/20 0.65
▸ RARB P10826 6/20 0.59
▸ RARA P10276 1/20 0.59
▸ MTOR P42345 1/20 0.59
▸ ESR1 P03372 2/20 0.57
▸ ADRA2A P08913 2/20 0.57
▸ ADORA3 P0DMS8 2/20 0.57
▸ TACR2 P21452 2/20 0.57
▸ SLC6A2 P23975 2/20 0.57
▸ SLC6A4 P31645 2/20 0.57

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
SCHEMBL12622274 0.88 ALDH1A1 (0.65) ALDH1A1HSD17B10KDM4EMEN1MAPT
SCHEMBL12622306 0.86 ALDH1A1 (0.63) ALDH1A1HSD17B10KDM4EMEN1MAPT
SCHEMBL2856420 0.86 ALDH1A1 (0.55) ALDH1A1HSD17B10KDM4EMEN1MAPT
SCHEMBL13539888 0.86 ALDH1A1 (0.62) ALDH1A1HSD17B10KDM4EMEN1MAPT
SCHEMBL11664281 0.85 HSD17B10 (0.71) ALDH1A1HSD17B10KDM4EMEN1MAPT
SCHEMBL11660215 0.85 HSD17B10 (0.71) ALDH1A1HSD17B10KDM4EMEN1MAPT
SCHEMBL11661972 0.85 HSD17B10 (0.71) ALDH1A1HSD17B10KDM4EMEN1MAPT
SCHEMBL11657350 0.85 HSD17B10 (0.71) ALDH1A1HSD17B10KDM4EMEN1MAPT
SCHEMBL25440302 0.85 HSD11B1 (0.54) ALDH1A1HSD17B10KDM4EMEN1MAPT
SCHEMBL9850312 0.83 MAPT (0.79) ALDH1A1HSD17B10KDM4EMEN1MAPT

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-4356103-A TETRAZINE, DICHROISM VEB WERK FUR FERNSEHELEKTRONIK (DD) 1982-10-26 — — US claimed
US-4356103-A TETRAZINE, DICHROISM VEB WERK FUR FERNSEHELEKTRONIK (DD) 1982-10-26 — — US disclosed
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