SCHEMBL17276663

SCHEMBL17276663

Cc1ccccc1-c1cnn(C(=O)N2CCCC2)c1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PLA2G7 Q13093 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.43
▸ GRIN2B Q13224 1/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ LMNA P02545 2/20 0.42
▸ POLB P06746 1/20 0.42
▸ TSHR P16473 1/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ NPC1 O15118 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ SLC6A7 Q99884 1/20 0.40
▸ TP53 P04637 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL17276373 0.81 HPGD (0.49) ALDH1A1MEN1KMT2ALMNATSHR
SCHEMBL17276563 0.80 HPGD (0.47) ALDH1A1MEN1KMT2ALMNAPOLB
SCHEMBL17276552 0.80 HPGD (0.51) ALDH1A1MEN1KMT2ALMNATSHR
SCHEMBL17276367 0.80 CNR1 (0.48) —
SCHEMBL19078698 0.79 FAAH (0.43) ALDH1A1GRIN2B
SCHEMBL17276317 0.79 NPC1 (0.44) ALDH1A1GRIN2BTSHRNPC1RAB9A
SCHEMBL17276646 0.78 NPC1 (0.43) MEN1KMT2APOLBTSHRNPC1
SCHEMBL17276798 0.78 DAGLA (0.46) ALDH1A1KMT2APOLBNPC1RAB9A
SCHEMBL19078697 0.77 CCNC (0.39) ALDH1A1LMNATSHR
SCHEMBL17276558 0.76 KDM4E (0.39) ALDH1A1NPSR1

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-2015179559-A2 PYRAZOLE COMPOUNDS AND METHODS OF MAKING AND USING SAME ABIDE THERAPEUTICS, INC. (US) 2015-11-26 — — WO disclosed
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