SCHEMBL7861380

SCHEMBL7861380

CC(C)CCCCCCNCc1ccccc1

nearest known ligand 0.71

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.71
CHRM2 P08172 2/20 0.69
SIGMAR1 Q99720 4/20 0.62
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
TDP1 Q9NUW8 1/20 0.55
HDAC3 O15379 1/20 0.51
HDAC1 Q13547 1/20 0.51
HDAC2 Q92769 1/20 0.51
HDAC8 Q9BY41 1/20 0.51
NCOR2 Q9Y618 1/20 0.51
FOLH1 Q04609 1/20 0.49
ACHE P22303 4/20 0.49

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
SCHEMBL640522 1.00 MAOA (0.71) MAOACHRM2SIGMAR1MEN1KMT2A
SCHEMBL372804 1.00 MAOA (0.71) MAOACHRM2SIGMAR1MEN1KMT2A
SCHEMBL6900998 1.00 MAOA (0.71) MAOACHRM2SIGMAR1MEN1KMT2A
SCHEMBL29380563 1.00 MAOA (0.71) MAOACHRM2SIGMAR1MEN1KMT2A
Iodide SCHEMBL8168717 0.98 MAOA (0.69) MAOACHRM2SIGMAR1MEN1KMT2A
Hydrochloric Acid SCHEMBL2789724 0.98 MAOA (0.69) MAOACHRM2SIGMAR1MEN1KMT2A
Hydrochloric Acid SCHEMBL199811 0.98 MAOA (0.69) MAOACHRM2SIGMAR1MEN1KMT2A
Hydrochloric Acid SCHEMBL767526 0.98 MAOA (0.69) MAOACHRM2SIGMAR1MEN1KMT2A
Water SCHEMBL8529965 0.98 MAOA (0.69) MAOACHRM2SIGMAR1MEN1KMT2A
Water SCHEMBL8529245 0.98 MAOA (0.69) MAOACHRM2SIGMAR1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0623608-B1 BENZOPYRAN DERIVATIVE, PRODUCTION THEREOF, AND PHARMACEUTICAL PREPARATION CONTAINING THE SAME AS ACTIVE INGREDIENT TEIJIN LTD (JP) 2001-05-30 EP disclosed
EP-0632031-B1 CONDENSED BENZOXA RING COMPOUND, PRODUCTION THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME TEIJIN LTD (JP) 2000-05-03 EP disclosed
EP-0546177-B1 BENZOPYRAN DERIVATIVE, PRODUCTION THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME TEIJIN LTD (JP) 1998-01-07 EP disclosed
US-5574061-A ANTILIPEMIC AGENT, ANTIATHEROSCLEROSIS, ACAT INHIBITOR TEIJIN LIMITED (JP) 1996-11-12 US disclosed
US-5496853-A FOR TREATING HYPERCHOLESTEROLEMIA TEIJIN LIMITED (JP) 1996-03-05 US disclosed
EP-0632031-A1 CONDENSED BENZOXA RING COMPOUND, PRODUCTION THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME TEIJIN LIMITED (JP) 1995-01-04 EP disclosed
EP-0623608-A1 BENZOPYRAN DERIVATIVE, PRODUCTION THEREOF, AND PHARMACEUTICAL PREPARATION CONTAINING THE SAME AS ACTIVE INGREDIENT TEIJIN LIMITED (JP) 1994-11-09 EP disclosed
EP-0546177-A1 BENZOPYRAN DERIVATIVE, PRODUCTION THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME TEIJIN LIMITED (JP) 1993-06-16 EP disclosed