SCHEMBL15310768

SCHEMBL15310768

Cc1cccnc1C1(F)CCN(c2ccc(N(C)C)cc2)CC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.38
▸ RAB9A P51151 4/20 0.38
▸ ALDH1A1 P00352 3/20 0.38
▸ NPC1 O15118 3/20 0.38
▸ L3MBTL1 Q9Y468 2/20 0.38
▸ LMNA P02545 2/20 0.38
▸ USP2 O75604 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ ALOX15 P16050 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ EGLN1 Q9GZT9 1/20 0.35
▸ EED O75530 3/20 0.35
▸ SLC2A1 P11166 1/20 0.34
▸ HRH3 Q9Y5N1 1/20 0.34
▸ PKM P14618 1/20 0.34
▸ AKT1 P31749 1/20 0.34
▸ PLK4 O00444 1/20 0.34

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
SCHEMBL5392020 0.82 EGLN1 (0.35) MAPTRAB9AALDH1A1NPC1L3MBTL1
SCHEMBL30102517 0.77 TRPV1 (0.58) MAPTALDH1A1LMNAKDM4EKMT2A
SCHEMBL2723517 0.77 TRPV1 (0.58) MAPTALDH1A1LMNAKDM4EKMT2A
SCHEMBL15310778 0.69 TRPV1 (0.47) TRPV1
SCHEMBL5732429 0.68 ALDH1A1 (0.38) ALDH1A1USP2HPGDHSD17B10KMT2A
SCHEMBL17543074 0.68 SLC2A1 (0.44) MAPTRAB9AALDH1A1NPC1L3MBTL1
SCHEMBL15310795 0.68 TRPV1 (0.44) MAPTRAB9AKMT2ATRPV1MALT1
SCHEMBL15312400 0.68 TRPV1 (0.63) ALDH1A1HPGDTRPV1
SCHEMBL2690334 0.67 NOS3 (0.36) RAB9AALDH1A1NPC1LMNAEGLN1
SCHEMBL9030925 0.67 ALDH1A1 (0.50) MAPTRAB9AALDH1A1NPC1L3MBTL1

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
US-20130274271-A1 METHODS AND COMPOSITIONS FOR PREVENTION AND TREATMENTOF CARDIAC HYPERTROPHY UNIVERSITY OF HAWAII (US) 2013-10-17 — — US claimed
US-20210069184-A1 METHODS AND COMPOSITIONS FOR PREVENTION AND TREATMENT OF CARDIAC HYPERTROPHY UNIV HAWAII (US) 2021-03-11 — — US disclosed
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