SCHEMBL1005697

SCHEMBL1005697

CCCCN=C=NC(C)C

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.38
CYP1A2 P05177 1/20 0.34
CYP2D6 P10635 1/20 0.34
TRPA1 O75762 1/20 0.31
TRPV1 Q8NER1 1/20 0.31

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
SCHEMBL9064503 0.91 NAAA (0.50) NAAACYP1A2CYP2D6
SCHEMBL19420506 0.85 NAAA (0.36) NAAACYP1A2CYP2D6TRPA1TRPV1
SCHEMBL157518 0.79 CYP1A2 (0.48) NAAACYP1A2CYP2D6
SCHEMBL898618 0.78 TRPA1 (0.32) CYP1A2CYP2D6TRPA1TRPV1
SCHEMBL11269557 0.77 CYP1A2 (0.41) CYP1A2CYP2D6
SCHEMBL23342232 0.76
SCHEMBL3275536 0.76 CYP1A2 (0.59) CYP1A2CYP2D6
Butyl Isothiocyanate SCHEMBL18154858 0.76 NAAA (0.59) NAAATRPA1TRPV1
SCHEMBL23342768 0.76 TRPA1 (0.52) TRPA1
Hydrochloric Acid SCHEMBL10619074 0.74 CYP1A2 (0.57) CYP1A2CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11739074-B2 Ras inhibitors Revolution Medicines, Inc. (US) 2023-08-29 US disclosed
US-11739074-B2 Ras inhibitors Revolution Medicines, Inc. (US) 2023-08-29 US disclosed
US-20230233569-A1 METHODS FOR DELAYING, PREVENTING, AND TREATING ACQUIRED RESISTANCE TO RAS INHIBITORS WILMINGTON TRUST, NATIONAL ASSOCIATION, AS AGENT 2023-07-27 US disclosed
CN-110234721-A Polyolefin adhesive composition 东洋纺株式会社 2019-09-13 CN disclosed
CN-110071189-A Backboard for solar cell module 爱克发-格法特公司 2019-07-30 CN disclosed
CN-108884308-A Poly carbonate resin composition and its molded product 株式会社钟化 2018-11-23 CN disclosed
CN-105359280-B Backsheet for photovoltaic modules 爱克发-格法特公司 2018-08-17 CN disclosed
CN-108369966-A Back sheet for solar cell module 爱克发-格法特公司 2018-08-03 CN disclosed
CN-108350156-A Polyester resin, process for producing the same, and polyester resin composition 三菱化学株式会社 2018-07-31 CN disclosed
CN-105451994-B Lamilate 三井化学株式会社 2018-05-11 CN disclosed
EP-2488585-A1 METHOD FOR CONTINUOUSLY PRODUCING POLYESTER MIXTURES BASF SE (DE) 2012-08-22 EP disclosed
CN-102286192-A Polyester film and method for producing same, backsheet for solar cell, and solar cell module 2011-12-21 CN disclosed
WO-2011045293-A1 METHOD FOR CONTINUOUSLY PRODUCING POLYESTER MIXTURES BASF SE (DE) 2011-04-21 WO disclosed
EP-2310453-A1 INCREASING THE HYDROLYSIS RESISTANCE OF BIODEGRADABLE POLYESTERS BASF SE (DE) 2011-04-20 EP disclosed
EP-2268702-A1 METHOD FOR THE CONTINUOUS PRODUCTION OF BIODEGRADABLE POLYESTERS BASF SE (DE) 2011-01-05 EP disclosed
EP-2268704-A1 METHOD FOR THE CONTINUOUS PRODUCTION OF BIODEGRADABLE POLYESTERS BASF SE (DE) 2011-01-05 EP disclosed
WO-2010012695-A1 INCREASING THE HYDROLYSIS RESISTANCE OF BIODEGRADABLE POLYESTERS BASF SE (DE) 2010-02-04 WO disclosed
WO-2009127555-A1 METHOD FOR THE CONTINUOUS PRODUCTION OF BIODEGRADABLE POLYESTERS BASF SE (DE) 2009-10-22 WO disclosed
WO-2009127556-A1 METHOD FOR THE CONTINUOUS PRODUCTION OF BIODEGRADABLE POLYESTERS BASF SE (DE) 2009-10-22 WO disclosed
WO-2008016841-A2 REDUCED ODOR RTV SILICONE ILLINOIS TOOL WORKS INC. (US) 2008-02-07 WO 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-11739074-B2 Ras inhibitors KRAS, NRAS, HRAS NAAA 4467/4885CYP1A2 4024/4885CYP2D6 2362/4885
US-20230233569-A1 METHODS FOR DELAYING, PREVENTING, AND TREATING ACQUIRED RESISTANCE TO RAS INHIBITORS KRAS, HRAS, MTOR NAAA 4467/4885CYP1A2 4879/4885CYP2D6 4714/4885

“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.