SCHEMBL186554

SCHEMBL186554

N#Cc1cccc(F)c1C#N

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.44
ALDH1A1 P00352 3/20 0.44
HPGD P15428 1/20 0.44
HSD17B10 Q99714 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.40
HIF1A Q16665 1/20 0.40
BCAT1 P54687 1/20 0.40
TSHR P16473 1/20 0.39
TRPV4 Q9HBA0 3/20 0.39
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CUL4A Q13619 1/20 0.36
TAS1R3 Q7RTX0 1/20 0.36
TAS1R1 Q7RTX1 1/20 0.36
TAS1R2 Q8TE23 1/20 0.36
MAPT P10636 1/20 0.35
MAOA P21397 1/20 0.35
MAOB P27338 1/20 0.35
DRD2 P14416 1/20 0.35
HTR2A P28223 1/20 0.35

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
SCHEMBL186269 0.85 ALDH1A1 (0.50) KDM4EALDH1A1HPGDHSD17B10BCAT1
SCHEMBL28351566 0.85 ALDH1A1 (0.41) KDM4EALDH1A1HPGDHSD17B10BCAT1
SCHEMBL16957365 0.85 ALDH1A1 (0.41) KDM4EALDH1A1HPGDHSD17B10SMN1; SMN2
SCHEMBL18297484 0.85 KDM4E (0.38) KDM4EALDH1A1HPGDHSD17B10SMN1; SMN2
SCHEMBL645262 0.82 TSHR (0.48) KDM4EALDH1A1SMN1; SMN2HIF1ATSHR
Cyanide SCHEMBL28871133 0.80 ALDH1A1 (0.47) KDM4EALDH1A1HPGDHSD17B10BCAT1
SCHEMBL30443847 0.78 BCAT1 (0.49) KDM4EALDH1A1HPGDHSD17B10BCAT1
SCHEMBL158537 0.78 BCAT1 (0.49) KDM4EALDH1A1HPGDHSD17B10BCAT1
Water SCHEMBL28049227 0.78 BCAT1 (0.49) KDM4EALDH1A1HPGDHSD17B10BCAT1
SCHEMBL19062287 0.78 ALDH1A1 (0.46) KDM4EALDH1A1HPGDHSD17B10BCAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119330339-A Method for preparing porous carbon based on synchronous synthesis of nitrile resin/graphene nanosheets and porous carbon material 成都大学 2025-01-21 CN claimed
CN-114512719-B Eutectic solvent-based electrolyte and application thereof 中国科学院青岛生物能源与过程研究所 2024-12-03 CN claimed
CN-114512719-A Eutectic solvent-based electrolyte and application thereof 中国科学院青岛生物能源与过程研究所 2022-05-17 CN claimed
CN-111875794-A Novel preparation method of nitrile resin monomer 成都大学 2020-11-03 CN claimed
JP-7082504-A None JP disclosed
JP-7118551-A None JP disclosed
JP-7118552-A None JP disclosed
US-20250234777-A1 SENSOR AND ELECTRONIC DEVICE SAMSUNG ELECTRONICS CO., LTD. (KR) 2025-07-17 US disclosed
US-12274168-B2 Compound, material for organic electroluminescent element, organic electroluminescent element, and electronic appliance IDEMITSU KOSAN CO., LTD. (JP) 2025-04-08 US disclosed
CN-119330339-A Method for preparing porous carbon based on synchronous synthesis of nitrile resin/graphene nanosheets and porous carbon material 成都大学 2025-01-21 CN disclosed
CN-114512719-B Eutectic solvent-based electrolyte and application thereof 中国科学院青岛生物能源与过程研究所 2024-12-03 CN disclosed
CN-114787288-B Colorant for heat transfer fluid and composition containing same KD精细化工有限公司 2024-02-13 CN disclosed
EP-0244780-A2 Photoconductive phthalocyanine pigments, electrophotographic elements containing them, and a method of use EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1987-11-11 EP disclosed
US-4701396-A ELECTROSTATIC CHANGING, EXPOSURE TO PATTERN OF INFRARED RADIATION, AND DEVELOPMENT EASTMAN KODAK COMPANY (US) 1987-10-20 US disclosed
US-4684734-A Method for manufacture or organic fluorine compounds NIPPON SHOKUBAI KK CO., LTD. (JP) 1987-08-04 US disclosed
US-4532240-A Antibacterial agents WARNER-LAMBERT COMPANY (US) 1985-07-30 US disclosed
EP-0120575-A1 Organic fluorine compounds Nippon Shokubai Kagaku Kogyo Co., Ltd (JP) 1984-10-03 EP disclosed
EP-0120575-A1 Organic fluorine compounds Nippon Shokubai Kagaku Kogyo Co., Ltd (JP) 1984-10-03 EP disclosed
EP-0103464-A2 Diaminopyrimidines and their production WARNER-LAMBERT COMPANY (US) 1984-03-21 EP disclosed
US-4239686-A Process for producing phthalimido derivatives ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1980-12-16 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-20250234777-A1 SENSOR AND ELECTRONIC DEVICE CTNNA1, CRY1, AXIN2 KDM4E 1573/4885ALDH1A1 2056/4885HPGD 620/4885
US-12274168-B2 Compound, material for organic electroluminescent element, organic electroluminescent element, and electronic appliance MLX, H1-0, RER1 KDM4E 388/4885ALDH1A1 3081/4885HPGD 4382/4885

“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.