SCHEMBL628010

SCHEMBL628010

N#Cc1cc(Cl)cc(C(F)(F)F)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.44
RXRA P19793 1/20 0.42
RXRG P48443 1/20 0.42
XDH P47989 1/20 0.40
TAS2R14 Q9NYV8 1/20 0.39
MRGPRX4 Q96LA9 3/20 0.38
DDR1 Q08345 2/20 0.38
RAPGEF4 Q8WZA2 2/20 0.38
RAPGEF3 O95398 1/20 0.36
AHR P35869 1/20 0.36
GABRP O00591 1/20 0.36
GABRD O14764 1/20 0.36
GABRA1 P14867 1/20 0.36
GABRB1 P18505 1/20 0.36
GABRG2 P18507 1/20 0.36
GABRB3 P28472 1/20 0.36
GABRA5 P31644 1/20 0.36
GABRA3 P34903 1/20 0.36
GABRA2 P47869 1/20 0.36
GABRB2 P47870 1/20 0.36

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
SCHEMBL26457729 0.85 RXRA (0.48) KIF11RXRARXRGXDHMRGPRX4
SCHEMBL1334073 0.84 KIF11 (0.52) KIF11RXRARXRGXDHTAS2R14
SCHEMBL25983036 0.84 KIF11 (0.52) KIF11RXRARXRGXDHTAS2R14
SCHEMBL11179307 0.79 KIF11 (0.44) KIF11RAPGEF4RAPGEF3GABRA1GABRB2
SCHEMBL16959975 0.79 RAPGEF4 (0.38) DDR1RAPGEF4RAPGEF3AHR
SCHEMBL16951929 0.79 GRM5 (0.39) RAPGEF4RAPGEF3AHR
SCHEMBL28434608 0.79 NOTUM (0.38) RAPGEF4RAPGEF3AHR
SCHEMBL18002036 0.78 RXRA (0.59) KIF11RXRARXRGXDHTAS2R14
SCHEMBL26454595 0.78 RXRA (0.43) KIF11RXRARXRGXDHRAPGEF4
Nitrogen SCHEMBL9592328 0.77 AHR (0.48) RAPGEF4AHR

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024024508-A1 COMPOSITION, FILM, OPTICAL FILTER, SOLID STATE IMAGING DEVICE, IMAGE DISPLAY DEVICE, INFRARED RADIATION SENSOR, AND METHOD FOR PRODUCING CAMERA MODULE 富士フイルム株式会社 2024-02-01 WO disclosed
CN-102459203-A Compositions and methods for modulating retinol binding to retinol binding protein 4(RBP4) IRM LLC 2012-05-16 CN disclosed
US-20120077854-A1 COMPOSITIONS AND METHODS FOR MODULATING RETINOL BINDING TO RETINOL BINDING PROTEIN 4 (RBP4) IRM LLC (BM) 2012-03-29 US disclosed
EP-2419412-A1 COMPOSITIONS AND METHODS FOR MODULATING RETINOL BINDING TO RETINOL BINDING PROTEIN 4 (RBP4) IRM LLC (BM) 2012-02-22 EP disclosed
WO-2010120741-A1 COMPOSITIONS AND METHODS FOR MODULATING RETINOL BINDING TO RETINOL BINDING PROTEIN 4 (RBP4) IRM LLC (US) 2010-10-21 WO disclosed
WO-2009156090-A2 INSECTICIDAL SULFUR-DERIVATIZED 1-AZINYLPYRAZOLES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2009-12-30 WO disclosed
US-7390803-B2 Tetrahydropyranyl cyclopentyl benzylamide modulators of chemokine receptor activity MERCK & CO., INC. (US) 2008-06-24 US disclosed
US-7390803-B2 Tetrahydropyranyl cyclopentyl benzylamide modulators of chemokine receptor activity MERCK & CO., INC. (US) 2008-06-24 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-20120077854-A1 COMPOSITIONS AND METHODS FOR MODULATING RETINOL BINDING TO RETINOL BINDING PROTEIN 4 (RBP4) RBP4, RBP1, FABP4 KIF11 3909/4885RXRA 11/4885RXRG 10/4885

“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.