SCHEMBL7334489

SCHEMBL7334489

c1ccc(C/N=C2\CCCN2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CRHBP P24387 1/20 0.38
CRHR2 Q13324 1/20 0.38
ALDH1A1 P00352 5/20 0.36
NPC1 O15118 1/20 0.36
MAPT P10636 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
MAPK1 P28482 2/20 0.35
HTT P42858 1/20 0.35
HPGD P15428 2/20 0.35
POLB P06746 1/20 0.35
PKM P14618 1/20 0.35
HSD11B1 P28845 2/20 0.35
TRPA1 O75762 1/20 0.34
CYP3A4 P08684 1/20 0.34
MIF P14174 1/20 0.34
LMNA P02545 2/20 0.34
TP53 P04637 1/20 0.34
KMT2A Q03164 1/20 0.34
NPSR1 Q6W5P4 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
SCHEMBL7334494 1.00 CRHBP (0.38) CRHBPCRHR2ALDH1A1NPC1MAPT
SCHEMBL7626970 0.95 CRHBP (0.37) CRHBPCRHR2ALDH1A1NPC1MAPT
SCHEMBL7334086 0.93 CRHBP (0.36) CRHBPCRHR2ALDH1A1NPC1MAPT
SCHEMBL10817028 0.82 TAAR1 (0.43) ALDH1A1MAPTHSD11B1TRPA1MIF
SCHEMBL7331603 0.79 NPC1 (0.38) ALDH1A1NPC1MAPTRAB9ASMN1; SMN2
SCHEMBL7331600 0.79 NPC1 (0.38) ALDH1A1NPC1MAPTRAB9ASMN1; SMN2
SCHEMBL9579895 0.74 CRBN (0.41) CRHBPCRHR2ALDH1A1MAPTMAPK1
SCHEMBL7333678 0.74 MIF (0.41) ALDH1A1NPC1MAPTRAB9ASMN1; SMN2
SCHEMBL7331097 0.72 CYP2D6 (0.41) ALDH1A1MAPTSMN1; SMN2MAPK1HPGD
SCHEMBL7626976 0.71 CRHBP (0.36) CRHBPCRHR2ALDH1A1NPC1MAPT

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5198433-A Hypotensive MERRELL DOW PHARMACEUTICALS INC. (US) 1993-03-30 US disclosed
US-5158945-A Cardiotonic agents, vasodilators, hypotensive agents, anticonvulsants, antiisichemic agents MERRELL DOW PHARMACEUTICALS INC. (US) 1992-10-27 US disclosed
EP-0370320-B1 LACTAMIMIDES IN THE TREATMENT OF DRUG-RESISTANT PROTOZOAL INFECTIONS MERRELL DOW PHARMACEUTICALS INC. (US) 1992-09-30 EP disclosed
US-5128337-A Hypotensive agents MERRELL DOW PHARMACEUTICALS INC. (US) 1992-07-07 US disclosed
US-5082837-A Hypotensive MERRELL DOW PHARMACEUTICALS (US) 1992-01-21 US disclosed
US-5010072-A Hypotensive agents MERRELL DOW PHARMACEUTICALS INC. (US) 1991-04-23 US disclosed
EP-0370320-A1 Lactamimides in the treatment of drug-resistant protozoal infections MERRELL DOW PHARMACEUTICALS INC. (US) 1990-05-30 EP disclosed
EP-0348891-A2 Lactamimides as calcium antagonists MERRELL DOW PHARMACEUTICALS INC. (US) 1990-01-03 EP disclosed
US-4061746-A Lactamimide inhibitors of gastrointestinal hypersecretion RICHARDSON-MERRELL INC. (US) 1977-12-06 US disclosed