SCHEMBL10154322

SCHEMBL10154322

CC1O[C@@H](c2ccc3c(N)ncnn23)[C@H](F)C1O

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ POLRMT O00411 1/20 0.39
▸ DOT1L Q8TEK3 3/20 0.36
▸ MAP4K4 O95819 1/20 0.35
▸ STING1 Q86WV6 1/20 0.35
▸ ADK P55263 10/20 0.34
▸ HSPA8 P11142 1/20 0.32

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
SCHEMBL19101901 0.83 POLRMT (0.40) POLRMTDOT1LADKHSPA8
SCHEMBL806951 0.83 POLRMT (0.40) POLRMTDOT1LADKHSPA8
SCHEMBL16479516 0.83 POLRMT (0.40) POLRMTDOT1LADKHSPA8
SCHEMBL10101549 0.80 POLRMT (0.36) POLRMTDOT1LMAP4K4STING1
SCHEMBL10101489 0.80 POLRMT (0.36) POLRMTDOT1LMAP4K4STING1
SCHEMBL4765244 0.79 POLRMT (0.35) POLRMTDOT1LMAP4K4
SCHEMBL4765238 0.79 POLRMT (0.35) POLRMTDOT1LMAP4K4
SCHEMBL881562 0.76 POLRMT (0.40) POLRMTDOT1LADKHSPA8
SCHEMBL10101548 0.76 POLRMT (0.40) POLRMTDOT1LMAP4K4STING1HSPA8
SCHEMBL18481207 0.76 POLRMT (0.39) POLRMTDOT1LADKHSPA8

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
WO-2012012776-A1 METHODS AND COMPOUNDS FOR TREATING PARAMYXOVIRIDAE VIRUS INFECTIONS GILEAD SCIENCES, INC. (US) 2012-01-26 — — WO disclosed
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