SCHEMBL7604179

SCHEMBL7604179

CCc1nn(-c2c(Cl)cc(C(F)(F)F)cc2Cl)c(N(C)C)c1CN1Cc2ccccc2CC1COC

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GABRB3 P28472 17/20 0.36
▸ GABRA2 P47869 11/20 0.36
▸ GABRB2 P47870 11/20 0.36
▸ GABRP O00591 7/20 0.33
▸ GABRD O14764 7/20 0.33
▸ GABRA1 P14867 7/20 0.33
▸ GABRB1 P18505 7/20 0.33
▸ GABRG2 P18507 7/20 0.33
▸ GABRA5 P31644 7/20 0.33
▸ GABRA3 P34903 7/20 0.33
▸ GABRA4 P48169 7/20 0.33
▸ GABRE P78334 7/20 0.33
▸ GABRA6 Q16445 7/20 0.33
▸ GABRG1 Q8N1C3 7/20 0.33
▸ GABRG3 Q99928 7/20 0.33
▸ GABRQ Q9UN88 7/20 0.33
▸ BCL2 P10415 1/20 0.33
▸ BAD Q92934 1/20 0.33
▸ TACR1 P25103 1/20 0.31
▸ TACR3 P29371 1/20 0.31

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
SCHEMBL7604165 0.93 GABRB3 (0.36) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL8783395 0.90 GABRB3 (0.37) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL8783693 0.90 GABRB3 (0.34) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL8330693 0.90 GABRB3 (0.42) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL8587701 0.85 GABRB3 (0.38) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL8505197 0.82 GABRB3 (0.41) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL8783619 0.81 CCNE2 (0.32) BCL2
SCHEMBL8783141 0.81 CCNE2 (0.35) BCL2BAD
SCHEMBL8351551 0.81 GABRP (0.43) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL8328971 0.81 GABRP (0.38) GABRB3GABRA2GABRB2GABRPGABRD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0691128-B1 Use of CRF antagonists PFIZER (US) 2002-12-11 — — EP claimed
US-6200979-B1 ADMINISTERING SUBSTITUTED PYRAZOLES AND PYZAZOLOPYRIMIDINES FOR TREATING PHOBIAS OBSESSIVE-COMPULSIVE DISORDER, POST-TRAUMATIC STRESS DISORDER, SINGLE EPISODE DEPRESSION, RECURRENT DEPRESSION, DYSTHYMIA, BIPOLAR DISORDERS BRIGHT GENE M (US) 2001-03-13 — — US claimed
EP-0674625-B1 AMINO-SUBSTITUTED PYRAZOLES HAVING CRF ANTAGONISTIC ACTIVITY PFIZER (US) 1997-12-10 — — EP claimed
US-5668145-A Amino-substituted pyrazoles having CRF antagonistic activity PFIZER INC. (US) 1997-09-16 — — US claimed
EP-0691128-A1 Methods of administering CRF antagonists PFIZER INC. (US) 1996-01-10 — — EP claimed
EP-0674625-A1 AMINO-SUBSTITUTED PYRAZOLES HAVING CRF ANTAGONISTIC ACTIVITY PFIZER INC. (US) 1995-10-04 — — EP claimed
WO-1994013644-A1 AMINO-SUBSTITUTED PYRAZOLES HAVING CRF ANTAGONISTIC ACTIVITY PFIZER INC. (US) 1994-06-23 — — WO claimed
EP-0691128-B1 Use of CRF antagonists PFIZER (US) 2002-12-11 — — EP disclosed
US-6200979-B1 ADMINISTERING SUBSTITUTED PYRAZOLES AND PYZAZOLOPYRIMIDINES FOR TREATING PHOBIAS OBSESSIVE-COMPULSIVE DISORDER, POST-TRAUMATIC STRESS DISORDER, SINGLE EPISODE DEPRESSION, RECURRENT DEPRESSION, DYSTHYMIA, BIPOLAR DISORDERS BRIGHT GENE M (US) 2001-03-13 — — US disclosed
EP-0674625-B1 AMINO-SUBSTITUTED PYRAZOLES HAVING CRF ANTAGONISTIC ACTIVITY PFIZER (US) 1997-12-10 — — EP disclosed
US-5668145-A Amino-substituted pyrazoles having CRF antagonistic activity PFIZER INC. (US) 1997-09-16 — — US disclosed
US-5646152-A Methods of administering CRF antagonists PFIZER INC. (US) 1997-07-08 — — US disclosed
EP-0691128-A1 Methods of administering CRF antagonists PFIZER INC. (US) 1996-01-10 — — EP disclosed
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