SCHEMBL8987387

SCHEMBL8987387

COc1ccc(C=CC(=O)c2ccc(Cl)cc2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 10/20 1.00
MAOA P21397 4/20 1.00
F3 P13726 2/20 0.84
MAPT P10636 4/20 0.75
XDH P47989 2/20 0.75
MEN1 O00255 2/20 0.75
ALDH1A1 P00352 2/20 0.75
KMT2A Q03164 2/20 0.75
P4HB P07237 1/20 0.75
CALM1 P0DP23 1/20 0.75
RAB9A P51151 1/20 0.75
NPC1 O15118 1/20 0.73
LMNA P02545 1/20 0.73
CYP1B1 Q16678 3/20 0.72
HSPD1 P10809 1/20 0.72
TNFRSF1A P19438 1/20 0.72
HSPE1 P61604 1/20 0.72
BCHE P06276 1/20 0.72
CYP3A4 P08684 1/20 0.72
NFKB1 P19838 1/20 0.72

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
SCHEMBL8987383 1.00 MAOB (1.00) MAOBMAOAF3MAPTXDH
SCHEMBL657702 1.00 MAOB (1.00) MAOBMAOAF3MAPTXDH
SCHEMBL657701 1.00 MAOB (1.00) MAOBMAOAF3MAPTXDH
Hydrochloric Acid SCHEMBL11823312 0.98 MAOB (0.97) MAOBMAOAF3MAPTXDH
Hydrochloric Acid SCHEMBL11823315 0.98 MAOB (0.97) MAOBMAOAF3MAPTXDH
4,4'-Dimethoxychalcone SCHEMBL978243 0.92 F3 (1.00) MAOBMAOAF3MAPTXDH
4,4'-Dimethoxychalcone SCHEMBL978242 0.92 F3 (1.00) MAOBMAOAF3MAPTXDH
4',4-Dichlorochalcone SCHEMBL659211 0.87 MAOB (0.86) MAOBMAOAF3MAPTCYP1B1
4',4-Dichlorochalcone SCHEMBL659210 0.87 MAOB (0.86) MAOBMAOAF3MAPTCYP1B1
SCHEMBL25189143 0.86 MAPT (1.00) MAOBMAOAF3MAPTXDH

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
US-20190008797-A1 ESTROGEN RECEPTOR ALPHA COLIGANDS, AND METHODS OF USE THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2019-01-10 US disclosed
WO-2017132135-A1 ESTROGEN RECEPTOR ALPHA COLIGANDS, AND METHODS OF USE THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2017-08-03 WO disclosed
US-9085520-B2 Composition for treating diabetes and metabolic diseases and a preparation method thereof KAOHSIUNG MEDICAL UNIVERSITY (TW) 2015-07-21 US disclosed
US-20140350304-A1 COMPOSITION FOR TREATING DIABETES AND METABOLIC DISEASES AND A PREPARATION METHOD THEREOF KAOHSIUNG MEDICAL UNIVERSITY (TW) 2014-11-27 US disclosed
WO-2013022951-A1 COMPOSITION FOR TREATING DIABETES AND METABOLIC DISEASES AND A PREPARATION METHOD THEREOF KAOHSIUNG MEDICAL UNIVERSITY (TW) 2013-02-14 WO disclosed
US-5492915-A ANTIINFLAMMATORY AGENTS RHONE-POULENC RORER S.A. (FR) 1996-02-20 US disclosed
US-5366982-A Antiinflammatory agents or antihistamines RHONE-POULENC RORER S.A. (FR) 1994-11-22 US disclosed
EP-0540604-A1 SUBSTITUTED BICYCLIC BIS-ARYL COMPOUNDS EXHIBITING SELECTIVE LEUKOTRIENE B 4? ANTAGONIST ACTIVITY, THEIR PREPARATION AND USE IN PHARMACEUTICAL COMPOSITIONS Aventis Pharma S.A. (FR) 1993-05-12 EP disclosed
WO-1992001675-A2 SUBSTITUTED BICYCLIC BIS-ARYL COMPOUNDS EXHIBITING SELECTIVE LEUKOTRIENE B4 ANTAGONIST ACTIVITY, THEIR PREPARATION AND USE IN PHARMACEUTICAL COMPOSITIONS RHONE-POULENC RORER S.A. (FR) 1992-02-06 WO disclosed
US-3931152-A ANTITUBERCULAR AMERICAN CYANAMID COMPANY (US) 1976-01-06 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20190008797-A1 ESTROGEN RECEPTOR ALPHA COLIGANDS, AND METHODS OF USE THEREOF ESRRG, GPER1, ESR2 MAOB 3735/4885MAOA 3153/4885F3 4864/4885
US-20140350304-A1 COMPOSITION FOR TREATING DIABETES AND METABOLIC DISEASES AND A PREPARATION METHOD THEREOF FABP1, GYS2, CYP7B1 MAOB 3332/4885MAOA 4277/4885F3 392/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.