SCHEMBL8649735

SCHEMBL8649735

CC1COC(c2cccc(F)c2)C(C)N1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.43
CYP19A1 P11511 1/20 0.37
IDO1 P14902 1/20 0.37
KDM1A O60341 1/20 0.36
RCOR1 Q9UKL0 1/20 0.36
MAOB P27338 2/20 0.36
MAOA P21397 1/20 0.36
HTR2B P41595 2/20 0.36
HTR2A P28223 1/20 0.36
HTR2C P28335 1/20 0.36
SLC6A2 P23975 2/20 0.35
SLC6A3 Q01959 2/20 0.35
SLC6A4 P31645 1/20 0.35
NR3C2 P08235 2/20 0.35
ADRA1A P35348 1/20 0.35
ALOX5 P09917 1/20 0.34
NOS3 P29474 1/20 0.34
GRM5 P41594 1/20 0.34
ALDH1A1 P00352 1/20 0.33
CYP3A4 P08684 1/20 0.33

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
SCHEMBL8649738 1.00 TAAR1 (0.43) TAAR1CYP19A1IDO1KDM1ARCOR1
SCHEMBL8663225 1.00 TAAR1 (0.43) TAAR1CYP19A1IDO1KDM1ARCOR1
Hydrochloric Acid SCHEMBL8660546 0.98 TAAR1 (0.42) TAAR1CYP19A1IDO1KDM1ARCOR1
Hydrochloric Acid SCHEMBL8650995 0.98 TAAR1 (0.42) TAAR1CYP19A1IDO1KDM1ARCOR1
Hydrochloric Acid SCHEMBL8837293 0.98 TAAR1 (0.42) TAAR1CYP19A1IDO1KDM1ARCOR1
Hydrochloric Acid SCHEMBL8663126 0.98 TAAR1 (0.42) TAAR1CYP19A1IDO1KDM1ARCOR1
Hydrochloric Acid SCHEMBL8660544 0.98 TAAR1 (0.42) TAAR1CYP19A1IDO1KDM1ARCOR1
Hydrochloric Acid SCHEMBL8663962 0.84 CYP19A1 (0.31) CYP19A1HTR2BSLC6A2SLC6A3ADRA1A
Hydrochloric Acid SCHEMBL8837340 0.84 CYP19A1 (0.31) CYP19A1HTR2BSLC6A2SLC6A3ADRA1A
Hydrochloric Acid SCHEMBL8663965 0.84 CYP19A1 (0.31) CYP19A1HTR2BSLC6A2SLC6A3ADRA1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0583271-B1 ARYLMORPHOLINE, PREPARATION AND USE WELLCOME FOUND (GB) 1998-11-11 EP claimed
US-5760224-A ANTIDEPRESSANTS FOR TREATING PSYCHOLOGICAL DISORDERS GLAXO WELLCOME INC. (US) 1998-06-02 US claimed
US-5648347-A ANTIDEPRESSANTS GLAXO WELLCOME INC. (US) 1997-07-15 US claimed
EP-0583271-A1 ARYLMORPHOLINE, PREPARATION AND USE THE WELLCOME FOUNDATION LIMITED (GB) 1994-02-23 EP claimed
WO-1992018489-A1 ARYLMORPHOLINE, PREPARATION AND USE THE WELLCOME FOUNDATION LIMITED (GB) 1992-10-29 WO claimed
EP-0583271-B1 ARYLMORPHOLINE, PREPARATION AND USE WELLCOME FOUND (GB) 1998-11-11 EP disclosed
US-5760224-A ANTIDEPRESSANTS FOR TREATING PSYCHOLOGICAL DISORDERS GLAXO WELLCOME INC. (US) 1998-06-02 US disclosed
US-5648347-A ANTIDEPRESSANTS GLAXO WELLCOME INC. (US) 1997-07-15 US disclosed
EP-0583271-A1 ARYLMORPHOLINE, PREPARATION AND USE THE WELLCOME FOUNDATION LIMITED (GB) 1994-02-23 EP disclosed
WO-1992018489-A1 ARYLMORPHOLINE, PREPARATION AND USE THE WELLCOME FOUNDATION LIMITED (GB) 1992-10-29 WO disclosed