SCHEMBL3708976

SCHEMBL3708976

N#CC(C#N)=C1CCCCC1

nearest known ligand 0.64

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.64
HSD17B10 Q99714 1/20 0.64
DRD2 P14416 1/20 0.39
DRD3 P35462 1/20 0.39
LMNA P02545 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HRH3 Q9Y5N1 4/20 0.33
GPR35 Q9HC97 1/20 0.33
EGFR P00533 1/20 0.30

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
SCHEMBL13349939 1.00 ALDH1A1 (0.64) ALDH1A1HSD17B10DRD2DRD3LMNA
SCHEMBL19973070 1.00 ALDH1A1 (0.64) ALDH1A1HSD17B10DRD2DRD3LMNA
SCHEMBL5508352 0.97 ALDH1A1 (0.60) ALDH1A1HSD17B10DRD2DRD3LMNA
SCHEMBL7524147 0.85 ALDH1A1 (0.55) ALDH1A1HSD17B10DRD2DRD3LMNA
SCHEMBL2786474 0.84 ALDH1A1 (0.46) ALDH1A1HSD17B10DRD2DRD3EGFR
Hydrochloric Acid SCHEMBL11032285 0.79 ALDH1A1 (0.43) ALDH1A1HSD17B10DRD2DRD3EGFR
SCHEMBL20990708 0.78 ALDH1A1 (0.44) ALDH1A1HSD17B10DRD2DRD3LMNA
SCHEMBL11199406 0.73 ALDH1A1 (0.43) ALDH1A1HSD17B10HRH3EGFR
SCHEMBL4273248 0.72 ALDH1A1 (0.39) ALDH1A1HSD17B10DRD2DRD3GPR35
SCHEMBL22826529 0.72 ALDH1A1 (0.39) ALDH1A1HSD17B10DRD2DRD3EGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110354881-B NxPreparation method of C-coated metal nanoparticle core-shell structure material 武汉大学 2020-06-23 CN claimed
EP-0278236-A1 Process for producing 7,7,8,8-Tetracyanoquinodimethane NITTO CHEMICAL INDUSTRY CO., LTD. (JP) 1988-08-17 EP claimed
EP-0073540-B1 PREPARATION OF TETRACYANOQUINODIMETHANE THE PROCTER & GAMBLE COMPANY (US) 1985-04-24 EP claimed
JP-60025961-A None JP disclosed
US-20250263377-A1 METHODS AND COMPOSITIONS FOR TERPENOID TRICYCLOALKANE SYNTHESIS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED 2025-08-21 US disclosed
US-20240376041-A1 METHODS AND COMPOSITIONS FOR TERPENOID SYNTHESIS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED 2024-11-14 US disclosed
US-12098115-B2 Methods and compositions for terpenoid synthesis UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2024-09-24 US disclosed
CN-118287150-A Method for efficiently catalyzing Knoevenagel condensation reaction by porphyrin and quaternary ammonium salt synergistic catalytic system 沈阳药科大学 2024-07-05 CN disclosed
US-11952327-B2 Methods and compositions for terpenoid synthesis UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2024-04-09 US disclosed
US-11912704-B2 Methods and compositions for substituted arylcycloheptane analogs UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2024-02-27 US disclosed
US-20240025843-A1 METHODS AND COMPOSITIONS FOR TERPENOID SYNTHESIS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. 2024-01-25 US disclosed
EP-0278236-A1 Process for producing 7,7,8,8-Tetracyanoquinodimethane NITTO CHEMICAL INDUSTRY CO., LTD. (JP) 1988-08-17 EP disclosed
US-4719245-A TRIMERIZATION CATALYST THE DOW CHEMICAL COMPANY (US) 1988-01-12 US disclosed
US-4703099-A CATALYTICALLY TRIMERIZING ISOCYANATES THE DOW CHEMICAL COMPANY (US) 1987-10-27 US disclosed
US-4632989-A KETENE AMINAL-OLEFIN REACTION PRODUCT AS CATALYSTS THE DOW CHEMICAL COMPANY (US) 1986-12-30 US disclosed
US-4536490-A REACTION PRODUCT OF KETENE-AMINAL AND UNSATURATED COMPOUND THE UPJOHN COMPANY (US) 1985-08-20 US disclosed
JP-S6025961-A DICYANOMETHYLENECYCLOHEXAN-4-ONE AND ITS PREPARATION TOYO SODA MFG CO LTD 1985-02-08 JP disclosed
EP-0019958-B1 SYNTHESIS OF 1,4-BIS(DICYANOMETHYLENE) CYCLOHEXANE AND USE THEREOF IN THE SYNTHESIS OF 7,7,8,8-TETRACYANOQUINODIMETHANE THE PROCTER & GAMBLE COMPANY (US) 1983-03-30 EP disclosed
US-4261988-A ANTICHOLESTEROL AGENTS USED IN ANIMAL HUSBANDRY BAYER AKTIENGESELLSCHAFT (DE) 1981-04-14 US disclosed
EP-0019958-A1 Synthesis of 1,4-bis(dicyanomethylene) cyclohexane and use thereof in the synthesis of 7,7,8,8-tetracyanoquinodimethane THE PROCTER & GAMBLE COMPANY (US) 1980-12-10 EP 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 (6 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-11952327-B2 Methods and compositions for terpenoid synthesis SQLE, GGPS1, LSS ALDH1A1 1162/4885HSD17B10 686/4885DRD2 1203/4885
US-20240376041-A1 METHODS AND COMPOSITIONS FOR TERPENOID SYNTHESIS SQLE, GGPS1, LSS ALDH1A1 1162/4885HSD17B10 686/4885DRD2 1203/4885
US-20250263377-A1 METHODS AND COMPOSITIONS FOR TERPENOID TRICYCLOALKANE SYNTHESIS LSS, GGPS1, DHPS ALDH1A1 2980/4885HSD17B10 280/4885DRD2 3888/4885
US-11912704-B2 Methods and compositions for substituted arylcycloheptane analogs AHR, HCCS, HMBS ALDH1A1 529/4885HSD17B10 198/4885DRD2 1498/4885
US-20240025843-A1 METHODS AND COMPOSITIONS FOR TERPENOID SYNTHESIS SQLE, GGPS1, LSS ALDH1A1 1162/4885HSD17B10 686/4885DRD2 1203/4885
US-12098115-B2 Methods and compositions for terpenoid synthesis SQLE, GGPS1, LSS ALDH1A1 1162/4885HSD17B10 686/4885DRD2 1203/4885

“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.