SCHEMBL730171

SCHEMBL730171

O=C=NC1CCc2ccccc2C1N=C=O

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.39
PDPK1 O15530 1/20 0.39
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CYP11B2 P19099 1/20 0.37
HTR6 P50406 3/20 0.36
MAOA P21397 3/20 0.36
MAOB P27338 3/20 0.36
BCHE P06276 1/20 0.36
ADRA2B P18089 1/20 0.36
ADRA2C P18825 1/20 0.36
ACHE P22303 1/20 0.36
ADRA1A P35348 1/20 0.36
PIN1 Q13526 1/20 0.36
ACP3 P15309 1/20 0.35
SRD5A1 P18405 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
SCHEMBL9617347 0.83 CHRNB2 (0.37) MAOAMAOB
SCHEMBL1148775 0.77 IDO1 (0.42) IDO1PDPK1CA1CA2CYP11B2
SCHEMBL3973439 0.77 IDO1 (0.42) IDO1PDPK1CA1CA2CYP11B2
SCHEMBL8445624 0.77 IDO1 (0.42) IDO1PDPK1CA1CA2CYP11B2
SCHEMBL1148693 0.77 IDO1 (0.42) IDO1PDPK1CA1CA2CYP11B2
SCHEMBL30523117 0.77 IDO1 (0.42) IDO1PDPK1CA1CA2CYP11B2
Water SCHEMBL27660893 0.76 IDO1 (0.41) IDO1PDPK1CA1CA2CYP11B2
SCHEMBL4703520 0.73 ACP3 (0.44) IDO1PDPK1CA1CA2CYP11B2
SCHEMBL29795931 0.71 IDO1 (0.45) IDO1
SCHEMBL3318970 0.71 IDO1 (0.45) IDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112384496-B Method for recovering diisocyanate from distillation residue 科思创德国股份有限公司 2024-02-02 CN claimed
EP-1506165-B1 TETRALIN ISOCYANATES BAYER MATERIALSCIENCE LLC (US) 2011-12-28 EP claimed
US-20060004153-A1 COMPOSITIONS FOR USE IN GOLF BALLS ACUSHNET COMPANY (US) 2006-01-05 US claimed
EP-0350414-B1 THICKENER MODIFIER OF THE RHEOLOGICAL PROPERTIES OF CHARGED AND/OR PIGMENTED, WHITE OR COLOURED AQUEOUS COMPOSITIONS Société COATEX, Société Anonyme (FR) 1992-04-22 EP claimed
US-5015711-A Copolymer used with charged pigments to form coating compositions COATEX S.A. (FR) 1991-05-14 US claimed
EP-0350414-A1 Thickener modifier of the rheological properties of charged and/or pigmented, white or coloured aqueous compositions Société COATEX, Société Anonyme (FR) 1990-01-10 EP claimed
EP-4340807-B1 HAIR COLOR COMPOSITIONS FOR MITIGATING COLOR LOSS LUBRIZOL ADVANCED MAT INC (US) 2026-01-28 EP disclosed
US-20240392173-A1 AQUEOUS DISPERSION CHUKYO YUSHI CO., LTD. (JP) 2024-11-28 US disclosed
US-20240252419-A1 HAIR COLOR COMPOSITIONS FOR MITIGATING COLOR LOSS LUBRIZOL ADVANCED MATERIALS, INC. (US) 2024-08-01 US disclosed
EP-4406737-A1 AQUEOUS DISPERSION Chukyo Yushi Co., Ltd. (JP) 2024-07-31 EP disclosed
CN-117777839-A Dual-curing high-gloss coating composition and preparation method and application thereof 长兴特殊材料(苏州)有限公司 2024-03-29 CN disclosed
US-20240101751-A1 HOLLOW MICROBALLOON TOKUYAMA CORPORATION (JP) 2024-03-28 US disclosed
EP-4340807-A1 HAIR COLOR COMPOSITIONS FOR MITIGATING COLOR LOSS Lubrizol Advanced Materials, Inc. (US) 2024-03-27 EP disclosed
US-4332710-A Thermal coagulation of polyurethane dispersions NORWOOD INDUSTRIES, INC. (US) 1982-06-01 US disclosed
US-4327195-A FOAMS CONTAINING FILLERS SETON COMPANY (US) 1982-04-27 US disclosed
US-4277299-A Release molds for laminating bilayer safety glass PPG INDUSTRIES, INC. (US) 1981-07-07 US disclosed
US-4171391-A Method of preparing composite sheet material WILMINGTON CHEMICAL CORPORATION (US) 1979-10-16 US disclosed
US-4073975-A WATER COATING ARMSTRONG CORK COMPANY (US) 1978-02-14 US disclosed
US-4006052-A POLYURETHANE ELASTOMER TENNECO CHEMICALS, INC. (US) 1977-02-01 US disclosed
US-3939021-A POLYURETHANE TOYO CLOTH CO., LTD. (JA) 1976-02-17 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 (1 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-20240252419-A1 HAIR COLOR COMPOSITIONS FOR MITIGATING COLOR LOSS TYR, DOT1L, CUTA IDO1 36/4885PDPK1 3616/4885CA1 1738/4885

“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.