SCHEMBL7704446

SCHEMBL7704446

COCc1ccc(OC)cc1C

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.46
ALDH1A1 P00352 2/20 0.46
APLNR P35414 1/20 0.44
KDM1A O60341 1/20 0.43
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43
IDO1 P14902 2/20 0.43
CYP11B1 P15538 1/20 0.43
CYP11B2 P19099 1/20 0.43
POLB P06746 1/20 0.42
HTT P42858 1/20 0.41
ESR1 P03372 1/20 0.41
CYP19A1 P11511 1/20 0.41
ESR2 Q92731 1/20 0.41
GAA P10253 1/20 0.41
TUBB4A P04350 1/20 0.41
TUBB P07437 1/20 0.41
TUBA3C P0DPH7 1/20 0.41
TUBA1B P68363 1/20 0.41
TUBA4A P68366 1/20 0.41

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
SCHEMBL7704442 0.84 ALDH1A1 (0.43) KMT2AALDH1A1APLNRKDM1AMAOA
SCHEMBL31019671 0.84 IDO1 (0.62) KMT2AALDH1A1APLNRKDM1AMAOA
SCHEMBL13703979 0.83 IDO1 (0.47) APLNRIDO1CYP11B1CYP11B2CA12
SCHEMBL11295684 0.83 GPR84 (0.47) KMT2AALDH1A1APLNRKDM1AMAOA
SCHEMBL18922735 0.81 ALDH1A1 (0.43) KMT2AALDH1A1POLBGAAKDM4E
SCHEMBL1690285 0.81 HTT (0.46) KMT2AALDH1A1APLNRKDM1AMAOA
SCHEMBL18361591 0.80 LTA4H (0.47) KMT2AALDH1A1KDM1AMAOAMAOB
SCHEMBL11317992 0.80 CYP3A4 (0.46) KMT2AALDH1A1MAOBPOLBGAA
SCHEMBL17943052 0.80 ALDH1A1 (0.41) KMT2AALDH1A1APLNRKDM1AMAOA
SCHEMBL31167335 0.80 APLNR (0.42) KMT2AALDH1A1APLNRKDM1AMAOA

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-3390394-B1 HYDANTOIN MODULATORS OF KV3 CHANNELS AUTIFONY THERAPEUTICS LTD (GB) 2022-05-25 EP disclosed
EP-2852588-B1 HYDANTOIN DERIVATIVES AS KV3 INHIBITORS AUTIFONY THERAPEUTICS LTD (GB) 2017-11-29 EP disclosed
WO-2017103604-A1 HYDANTOIN MODULATORS OF KV3 CHANNELS AUTIFONY THERAPEUTICS LIMITED (GB) 2017-06-22 WO disclosed
US-6342501-B1 VIRICIDES THE REGENTS OF THE UNIVERSITY OF MICHIGAN 2002-01-29 US disclosed
WO-2000042043-A1 PYRROLO[2,3-d]PYRIMIDINES AS ANTIVIRAL AGENTS THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2000-07-20 WO disclosed
EP-0746559-A1 PYRROLO(2,3-D)PYRIMIDINE DERIVATIVES AS ANTIVIRALS The Regents of The University of Michigan (US) 1996-12-11 EP disclosed
US-5543413-A VIRAL ACTIVITY AGAINST HUMAN CYTOMEGALOVIRUS AND HERPES SIMPLEX VIRUS REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 1996-08-06 US disclosed
WO-1995023151-A1 PYRROLO(2,3-D)PYRIMIDINE DERIVATIVES AS ANTIVIRALS THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 1995-08-31 WO disclosed