SCHEMBL18835150

SCHEMBL18835150

CCCCOc1nc2c(n1CCC(C)C)C1OC1N(CCCO)C(=O)N2C

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.31
▸ ALDH1A1 P00352 2/20 0.30
▸ TSHR P16473 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL16076144 0.66 MAOA (0.51) MAPTALDH1A1TSHRSMN1; SMN2
SCHEMBL16029058 0.61 USP2 (0.58) MAPTALDH1A1TSHRSMN1; SMN2
SCHEMBL20432383 0.59 — —
SCHEMBL18834440 0.59 CNR2 (0.34) —
SCHEMBL21316262 0.59 P2RX3 (0.41) ALDH1A1
SCHEMBL20432297 0.58 PDE4B (0.30) —
SCHEMBL16027666 0.56 PDE4B (0.49) MAPTALDH1A1TSHRSMN1; SMN2
SCHEMBL11315146 0.54 GBA1 (0.40) MAPTALDH1A1TSHR
SCHEMBL21876011 0.51 TDP1 (0.44) MAPTSMN1; SMN2
SCHEMBL31278668 0.50 ALDH1A1 (0.43) MAPTALDH1A1SMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2970303-B1 SUBSTITUTED XANTHINES AND METHODS OF USE THEREOF HYDRA BIOSCIENCES INC (US) 2017-05-10 — — EP disclosed
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