SCHEMBL15560269

SCHEMBL15560269

CCn1nnc(-c2cnn(-c3ccccc3F)c2Br)n1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KCNN4 O15554 7/20 0.40
▸ ATM Q13315 2/20 0.40
▸ SMN1; SMN2 Q16637 3/20 0.38
▸ LMNA P02545 1/20 0.38
▸ NPC1 O15118 4/20 0.38
▸ RAB9A P51151 4/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ MAPT P10636 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ TSHR P16473 1/20 0.36
▸ TRPM8 Q7Z2W7 2/20 0.36
▸ NFKB1 P19838 1/20 0.36
▸ NFKB2 Q00653 1/20 0.36
▸ RELA Q04206 1/20 0.36

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
SCHEMBL15554391 0.88 RAB9A (0.40) SMN1; SMN2LMNANPC1RAB9AALDH1A1
SCHEMBL15555060 0.87 TRPM8 (0.43) SMN1; SMN2LMNANPC1RAB9AALDH1A1
SCHEMBL15543006 0.86 RAB9A (0.49) ATMSMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL15553430 0.86 ATM (0.40) KCNN4ATMSMN1; SMN2LMNANPC1
SCHEMBL15555466 0.86 PIM1 (0.41) KCNN4ATMSMN1; SMN2LMNANPC1
SCHEMBL15556004 0.86 ATM (0.40) KCNN4ATMSMN1; SMN2LMNANPC1
SCHEMBL15555317 0.85 ATM (0.39) KCNN4ATMSMN1; SMN2LMNANPC1
SCHEMBL15560549 0.83 NPC1 (0.45) KCNN4SMN1; SMN2NPC1RAB9AMAPT
SCHEMBL15542982 0.83 LMNA (0.41) SMN1; SMN2LMNANPC1RAB9AALDH1A1
SCHEMBL15554204 0.82 ALDH1A1 (0.42) ATMSMN1; SMN2NPC1RAB9AALDH1A1

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-2014002109-A1 SUBSTITUTED TETRAZOLE COMPOUNDS AND PROCESS THEREOF RALLIS INDIA LIMITED (IN) 2014-01-03 — — WO disclosed
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