SCHEMBL1400789

SCHEMBL1400789

O=C(O)Nc1ccnc(Cl)c1

nearest known ligand 0.68

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SMARCA2 P51531 9/20 0.68
SMARCA4 P51532 8/20 0.68
SORT1 Q99523 1/20 0.48
GRM5 P41594 2/20 0.47
CNR1 P21554 1/20 0.44
HDAC4 P56524 1/20 0.44
AR P10275 1/20 0.43
JAK2 O60674 2/20 0.43
TYK2 P29597 2/20 0.43
S1PR2 O95136 1/20 0.42

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
SCHEMBL9599834 0.86 SMARCA2 (0.86) SMARCA2SMARCA4CNR1S1PR2
SCHEMBL9278345 0.83 SMARCA2 (0.65) SMARCA2SMARCA4GRM5HDAC4AR
SCHEMBL31434913 0.83 SMARCA2 (0.66) SMARCA2SMARCA4GRM5JAK2TYK2
SCHEMBL4175713 0.83 SMARCA2 (0.66) SMARCA2SMARCA4GRM5JAK2TYK2
SCHEMBL5145795 0.83 SMARCA2 (0.65) SMARCA2SMARCA4ARJAK2TYK2
SCHEMBL119685 0.82 SMARCA2 (0.79) SMARCA2SMARCA4CNR1
SCHEMBL17804195 0.81 SMARCA2 (0.64) SMARCA2SMARCA4GRM5ARJAK2
SCHEMBL22125195 0.81 SMARCA2 (1.00) SMARCA2SMARCA4SORT1GRM5CNR1
SCHEMBL6526162 0.81 CNR1 (0.51) SMARCA2SMARCA4CNR1
SCHEMBL28821933 0.81 JAK2 (0.63) SMARCA2SMARCA4HDAC4JAK2TYK2

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 44 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12037324-B2 Biarylmethyl heterocycles BRISTOL-MYERS SQUIBB COMPANY (US) 2024-07-16 US disclosed
US-11958846-B2 Urea compounds and compositions as SMARCA2/BRM ATPase inhibitors NOVARTIS AG (CH) 2024-04-16 US disclosed
EP-3478672-B1 BIARYLMETHYL HETEROCYCLES UNIV MONTREAL (CA) 2024-04-10 EP disclosed
US-20230322724-A1 HETEROCYCLIC COMPOUNDS AS CBP/EP300 BROMODOMAIN INHIBITORS AURIGENE ONCOLOGY LIMITED (IN) 2023-10-12 US disclosed
EP-4219488-A1 METHOD FOR THE PREPARATION OF UREA COMPOUNDS AS SMARCA2/BRM-ATPASE INHIBITORS Novartis AG (CH) 2023-08-02 EP disclosed
EP-4210683-A1 HETEROCYCLIC COMPOUNDS AS CBP/EP300 BROMODOMAIN INHIBITORS Aurigene Oncology Limited (IN) 2023-07-19 EP disclosed
EP-3837256-B1 UREA COMPOUNDS AND COMPOSITIONS AS SMARCA2/BRM-ATPASE INHIBITORS NOVARTIS AG (CH) 2023-03-08 EP disclosed
US-20230045357-A1 BIARYLMETHYL HETEROCYCLES Université de Montréal (CA) 2023-02-09 US disclosed
WO-2022053967-A1 HETEROCYCLIC COMPOUNDS AS CBP/EP300 BROMODOMAIN INHIBITORS AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2022-03-17 WO disclosed
US-11168086-B2 Methods of synthesizing pyrazine compounds HOFFMANN-LA ROCHE INC. (US) 2021-11-09 US disclosed
EP-1898903-A2 INHIBITORS OF AKT ACTIVITY Merck & Co., Inc. (US) 2008-03-19 EP disclosed
US-20080027077-A1 Novel biaromatic compounds that modulate PPARgamma type receptors and cosmetic/pharmaceutical compositions comprised thereof GALDERMA RESEARCH & DEVELOPMENT (FR) 2008-01-31 US disclosed
CN-101103012-A Compounds modulating PPAR gamma type receptors and their use in cosmetic or pharmaceutical compositions GALDERMA RES & DEV (FR) 2008-01-09 CN disclosed
EP-1827436-A2 INHIBITORS OF AKT ACTIVITY Merck & Co., Inc. (US) 2007-09-05 EP disclosed
WO-2006135627-A2 INHIBITORS OF AKT ACTIVITY MERCK & CO., INC. (US) 2006-12-21 WO disclosed
WO-2006065601-A2 INHIBITORS OF AKT ACTIVITY MERCK & CO., INC. (US) 2006-06-22 WO disclosed
US-20060089371-A1 Phenyl or heteroaryl amino alkane derivatives as ip receptor antagonist BAYER HEALTHCARE AG (DE) 2006-04-27 US disclosed
EP-1575919-A1 PHENYL OR HETEROARYL AMINO ALKANE DERIVATIVES AS IP RECEPTOR ANTAGONIST Bayer HealthCare AG (DE) 2005-09-21 EP disclosed
WO-2004043926-A1 PHENYL OR HETEROARYL AMINO ALKANE DERIVATIVES AS IP RECEPTOR ANTAGONIST BAYER HEALTHCARE AG (DE) 2004-05-27 WO disclosed
CN-1291892-A Substituted oxoazaheterocyclyl factor Xa inhibitors AWENTIS PHARMACEUTICAL INC (US) 2001-04-18 CN 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 (7 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-11958846-B2 Urea compounds and compositions as SMARCA2/BRM ATPase inhibitors SMARCC1, SMARCC2, SMARCA1 SMARCA2 4/4885SMARCA4 7/4885SORT1 3521/4885
US-20230322724-A1 HETEROCYCLIC COMPOUNDS AS CBP/EP300 BROMODOMAIN INHIBITORS EP300, HDAC1, BRD3 SMARCA2 94/4885SMARCA4 102/4885SORT1 4684/4885
US-11168086-B2 Methods of synthesizing pyrazine compounds CYP3A5, HAVCR2, HCCS SMARCA2 4523/4885SMARCA4 4378/4885SORT1 4198/4885
US-20080027077-A1 Novel biaromatic compounds that modulate PPARgamma type receptors and cosmetic/pharmaceutical compositions comprised thereof PPARG, PPARD, PPARA SMARCA2 2375/4885SMARCA4 1832/4885SORT1 2759/4885
US-12037324-B2 Biarylmethyl heterocycles ARRB1, ADRB2, ADRB1 SMARCA2 3724/4885SMARCA4 3628/4885SORT1 4807/4885
US-20230045357-A1 BIARYLMETHYL HETEROCYCLES ARRB1, ADRB2, ADRB1 SMARCA2 3724/4885SMARCA4 3628/4885SORT1 4807/4885
US-20060089371-A1 Phenyl or heteroaryl amino alkane derivatives as ip receptor antagonist BPHL, HRH4, HRH2 SMARCA2 4692/4885SMARCA4 4333/4885SORT1 4454/4885

“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.