SCHEMBL9405310

SCHEMBL9405310

CN(C)CCCc1ccc(-c2cc[nH]n2)cc1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ HRH3 Q9Y5N1 4/20 0.46
▸ KCNH2 Q12809 2/20 0.41
▸ MAPT P10636 1/20 0.41
▸ SIGMAR1 Q99720 1/20 0.41
▸ LMNA P02545 1/20 0.38
▸ LSS P48449 1/20 0.37
▸ TAAR1 Q96RJ0 2/20 0.36
▸ AKT2 P31751 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
SCHEMBL23574683 0.82 MAPT (0.55) MAPT
SCHEMBL9671700 0.77 HRH3 (0.74) HRH3KCNH2SIGMAR1LMNALSS
SCHEMBL9670561 0.75 SIGMAR1 (0.64) HRH3KCNH2SIGMAR1LMNATAAR1
SCHEMBL28571095 0.75 TDP1 (0.39) MAPTAKT2
SCHEMBL10176696 0.74 METAP2 (0.55) MAPTLMNA
SCHEMBL16766999 0.73 LMNA (0.36) MAPTLMNA
SCHEMBL6520645 0.71 FYN (0.39) —
SCHEMBL20575158 0.71 METAP2 (0.34) MAPT
SCHEMBL17091200 0.71 HRH3 (0.50) HRH3TAAR1AKT2
SCHEMBL26785656 0.71 METAP2 (0.34) MAPT

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
JP-6206872-A — — None — — JP disclosed
JP-H06206872-A CONDENSED TYPE PYRAZOLE COMPOUND YOSHITOMI PHARMACEUT IND LTD 1994-07-26 — — JP disclosed
Send feedback