SCHEMBL195209

SCHEMBL195209

Cc1ccc(Br)cc1C(F)(F)F

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 2/20 0.46
S1PR1 P21453 5/20 0.41
PDE3B Q13370 1/20 0.40
PDE3A Q14432 1/20 0.40
NOTUM Q6P988 1/20 0.39
S1PR4 O95977 1/20 0.38
TAS2R14 Q9NYV8 1/20 0.37
ALKBH5 Q6P6C2 1/20 0.36
HRH4 Q9H3N8 1/20 0.36
OPRM1 P35372 1/20 0.36
HCAR1 Q9BXC0 1/20 0.36
ALDH1A1 P00352 2/20 0.35
P2RX7 Q99572 1/20 0.34
MAPK1 P28482 1/20 0.34

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
SCHEMBL30602705 1.00 KDM1A (0.46) KDM1AS1PR1PDE3BPDE3ANOTUM
SCHEMBL29426988 0.82 KDM1A (0.42) KDM1ANOTUMS1PR4HRH4OPRM1
SCHEMBL869450 0.82 KDM1A (0.42) KDM1ANOTUMS1PR4HRH4OPRM1
SCHEMBL10328468 0.79 PTGDR2 (0.43) KDM1AALDH1A1MAPK1
SCHEMBL30864218 0.78 KDM1A (0.50) KDM1ANOTUMS1PR4HRH4HCAR1
SCHEMBL6267032 0.78 KDM1A (0.50) KDM1ANOTUMS1PR4HRH4HCAR1
SCHEMBL5949403 0.76 NOTUM (0.53) S1PR1PDE3BPDE3ANOTUMTAS2R14
SCHEMBL31373429 0.76 KDM1A (0.48) KDM1APDE3BPDE3ANOTUMTAS2R14
SCHEMBL5574275 0.76 GLA (0.54) KDM1AS1PR4HRH4HCAR1
SCHEMBL84053 0.76 SMN1; SMN2 (0.44) S1PR1PDE3BPDE3ANOTUMTAS2R14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3692101-B1 BRILLIANT BLUE (BBG) DYE DERIVATIVES AND STAINING COMPOSITIONS COMPRISING THE SAME FOR SELECTIVELY STAINING BIOLOGICAL SUBSTRATES ALFA INSTR S R L (IT) 2022-01-12 EP claimed
CN-107915570-B Preparation method of 4-bromo-1-methyl-2- (trifluoromethyl) benzene 金凯(辽宁)化工有限公司 2020-09-22 CN claimed
EP-3692101-A1 BRILLIANT BLUE (BBG) DYE DERIVATIVES AND STAINING COMPOSITIONS COMPRISING THE SAME FOR SELECTIVELY STAINING BIOLOGICAL SUBSTRATES Alfa Instruments S.r.l. (IT) 2020-08-12 EP claimed
EP-3543319-A1 METHOD OF MARKING HYDROCARBON LIQUIDS Johnson Matthey Public Limited Company (GB) 2019-09-25 EP claimed
WO-2019068935-A1 BRILLIANT BLUE (BBG) DYE DERIVATIVES AND STAINING COMPOSITIONS COMPRISING THE SAME FOR SELECTIVELY STAINING BIOLOGICAL SUBSTRATES ALFA INSTRUMENTS S.R.L. (IT) 2019-04-11 WO claimed
US-20140120626-A1 METHOD OF MARKING HYDROCARBON LIQUIDS JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2014-05-01 US claimed
EP-2707465-A1 METHOD OF MARKING HYDROCARBON LIQUIDS Johnson Matthey Public Limited Company (GB) 2014-03-19 EP claimed
WO-2012153132-A1 METHOD OF MARKING HYDROCARBON LIQUIDS JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2012-11-15 WO claimed
US-4436941-A Process for the isomerization of alkylbenzotrifluorides BAYER AKTIENGESELLSCHAFT (DE) 1984-03-13 US claimed
US-20260125378-A2 Heterocyclic Compounds BEONE MEDICINES I GMBH (CH) 2026-05-07 US disclosed
EP-4103557-B1 MONOACYLGLYCEROL LIPASE MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2026-02-18 EP disclosed
US-20260022130-A1 HETEROCYCLIC COMPOUNDS AS MONOACYLGLYCEROL LIPASE INHIBITORS HOFFMANN-LA ROCHE INC. (US) 2026-01-22 US disclosed
US-12502378-B2 Monoacylglycerol lipase modulators for use in autism spectrum disorders JANSSEN PHARMACEUTICA NV (BE) 2025-12-23 US disclosed
US-20250353846-A1 Heterocyclic Compounds BEONE MEDICINES I GMBH (CH) 2025-11-20 US disclosed
WO-2005068463-A1 DIAZA-SPIROPIPERIDINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2005-07-28 WO disclosed
US-20050154001-A1 Diaza-spiropiperidine derivatives HOFFMANN-LA ROCHE INC. 2005-07-14 US disclosed
EP-0084648-B1 PROCESS FOR THE ISOMERIZATION OF ALKYLBENZOTRIFLUORIDES BAYER AG (DE) 1984-11-07 EP disclosed
US-4436941-A Process for the isomerization of alkylbenzotrifluorides BAYER AKTIENGESELLSCHAFT (DE) 1984-03-13 US disclosed
EP-0084648-A1 Process for the isomerization of alkylbenzotrifluorides BAYER AG (DE) 1983-08-03 EP disclosed
US-4132737-A ENZYME INHIBITORS ELI LILLY AND COMPANY (US) 1979-01-02 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 (5 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-20260125378-A2 Heterocyclic Compounds NFATC1, CD4, MALT1 KDM1A 2115/4885S1PR1 904/4885PDE3B 2713/4885
US-20260022130-A1 HETEROCYCLIC COMPOUNDS AS MONOACYLGLYCEROL LIPASE INHIBITORS LIPC, LIPA, LPL KDM1A 1310/4885S1PR1 977/4885PDE3B 1117/4885
US-20250353846-A1 Heterocyclic Compounds NFATC1, CD4, ACIN1 KDM1A 2061/4885S1PR1 2617/4885PDE3B 1880/4885
US-20050154001-A1 Diaza-spiropiperidine derivatives HCN3, SCN3A, SLC6A3 KDM1A 2461/4885S1PR1 972/4885PDE3B 293/4885
US-12502378-B2 Monoacylglycerol lipase modulators for use in autism spectrum disorders LIPC, LPL, MGLL KDM1A 350/4885S1PR1 807/4885PDE3B 320/4885

“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.