SCHEMBL678227

SCHEMBL678227

CC(Br)c1ccc(C(F)(F)F)cc1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 2/20 0.50
GSK3B P49841 1/20 0.45
CES2 O00748 2/20 0.42
CES1 P23141 2/20 0.42
ALDH1A1 P00352 2/20 0.40
ACP3 P15309 1/20 0.40
TSHR P16473 1/20 0.40
KIF11 P52732 5/20 0.39
AKR1C3 P42330 1/20 0.39
AKR1C2 P52895 1/20 0.39
ORAI1 Q96D31 1/20 0.38
ORAI2 Q96SN7 1/20 0.38
ORAI3 Q9BRQ5 1/20 0.38
TRPV6 Q9H1D0 1/20 0.38
MGLL Q99685 1/20 0.38

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
SCHEMBL3743555 0.98 PDE2A (0.48) PDE2AGSK3BCES2CES1ALDH1A1
SCHEMBL28062297 0.84 PDE2A (0.44) PDE2AGSK3B
SCHEMBL1046560 0.81 PDE2A (0.50) PDE2AGSK3BCES2CES1ALDH1A1
SCHEMBL84043 0.80 PDE2A (0.53) PDE2ACES2CES1ALDH1A1ACP3
SCHEMBL3631522 0.80 GSK3B (0.48) PDE2AGSK3BCES2CES1ALDH1A1
SCHEMBL4428819 0.80 GSK3B (0.48) PDE2AGSK3BCES2CES1ALDH1A1
SCHEMBL1415320 0.79 ESR1 (0.38)
SCHEMBL6337812 0.79 NR1H2 (0.53)
SCHEMBL7438101 0.78 PDE2A (0.52) PDE2ACES2CES1ALDH1A1ACP3
Ammonia Solution, Strong SCHEMBL27642816 0.78 PDE2A (0.52) PDE2ACES2CES1ALDH1A1ACP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102344440-B Anticoccidial compound for livestock and poultry and preparation method thereof CHINA ANIMAL HUSBANDRY INDUSTRY CO LTD 2013-10-30 CN claimed
CN-102344440-A Anticoccidial compound for livestock and poultry and preparation method thereof CHINA ANIMAL HUSBANDRY INDUSTRY CO LTD 2012-02-08 CN claimed
EP-4692085-A2 PROSTAGLANDIN EP4 RECEPTOR ANTAGONIST COMPOUNDS Nxera Pharma UK Limited (GB) 2026-02-11 EP disclosed
US-20260015314-A1 PROSTAGLANDIN EP4 RECEPTOR ANTAGONIST COMPOUNDS NXERA PHARMA UK LTD (GB) 2026-01-15 US disclosed
US-20260000642-A1 PYRROLES AND IMIDAZOLES AS BET PROTEIN INHIBITORS TAY THERAPEUTICS LTD (GB) 2026-01-01 US disclosed
EP-4041388-B1 PROSTAGLANDIN EP4 RECEPTOR ANTAGONIST COMPOUNDS NXERA PHARMA UK LTD (GB) 2025-11-26 EP disclosed
US-20250263370-A1 PYRROLES AND IMIDAZOLES AS BET PROTEIN INHIBITORS Tay Therapeutics Limited (GB) 2025-08-21 US disclosed
US-12391641-B2 Prostaglandin EP4 receptor antagonist compounds Nxera Pharma UK Limitied (GB) 2025-08-19 US disclosed
CN-113072546-B Five-membered heteroaromatic derivative and preparation method and application thereof 广东东阳光药业股份有限公司 2025-05-30 CN disclosed
EP-4558224-A1 PYRROLES AND IMIDAZOLES AS BET PROTEIN INHIBITORS Tay Therapeutics Limited (GB) 2025-05-28 EP disclosed
CN-119819362-A Photocatalyst for efficiently catalyzing and synthesizing halogenated aromatic hydrocarbon as well as preparation method and application thereof 中国石油大学(华东) 2025-04-15 CN disclosed
EP-1541550-A1 ORGANIC TELLURIUM COMPOUND, PROCESS FOR PRODUCING THE SAME, LIVING RADICAL POLYMERIZATION INITIATOR, PROCESS FOR PRODUCING POLYMER WITH THE SAME, AND POLYMER Otsuka Chemical Co., Ltd. (JP) 2005-06-15 EP disclosed
WO-2005013985-A1 TREATMENT FOR ALZHEIMER'S DISEASE AND RELATED CONDITIONS MERCK SHARP & DOHME LIMITED (GB) 2005-02-17 WO disclosed
CN-1178927-C Histamine H3 receptor ligands ��ղķ˹����Ƕ� 2004-12-08 CN disclosed
CN-1296478-A Histamine H3 receptor ligands BLACK JAMES FOUNDATION (GB) 2001-05-23 CN disclosed
EP-0718264-B1 A liquid crystalline compound containing fluorine atom substituted alkyl group(s) and a liquid crystal composition CHISSO CORP (JP) 1999-11-17 EP disclosed
US-5702641-A ELECTRICAL AND CHEMICAL STABILITY CHISSO CORPORATION (JP) 1997-12-30 US disclosed
EP-0718264-A1 A liquid crystalline compound containing fluorine atom substituted alkyl group(s) and a liquid crystal composition Chisso Corporation (JP) 1996-06-26 EP disclosed
US-5026729-A Lipoxygenase inhibiting compounds ABBOTT LABORATORIES (US) 1991-06-25 US disclosed
US-4185992-A Imidazole derivatives MAY & BAKER LIMITED (GB) 1980-01-29 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 (4 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-12391641-B2 Prostaglandin EP4 receptor antagonist compounds PTGER1, PTGER4, PTGER2 PDE2A 358/4885GSK3B 4103/4885CES2 3666/4885
US-20260000642-A1 PYRROLES AND IMIDAZOLES AS BET PROTEIN INHIBITORS BET1, BRD4, PHKB PDE2A 3114/4885GSK3B 2851/4885CES2 2325/4885
US-20250263370-A1 PYRROLES AND IMIDAZOLES AS BET PROTEIN INHIBITORS BET1, PHKB, BRD4 PDE2A 3629/4885GSK3B 2014/4885CES2 4265/4885
US-20260015314-A1 PROSTAGLANDIN EP4 RECEPTOR ANTAGONIST COMPOUNDS PTGER4, PTGER1, PTGER3 PDE2A 628/4885GSK3B 3073/4885CES2 3883/4885

“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.