SCHEMBL7475783

SCHEMBL7475783

COc1ccc(CN2CCC(NC(=O)OC(C)(C)C)CC2)cc1

nearest known ligand 0.65

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 5/20 0.65
DRD4 P21917 2/20 0.59
MCHR1 Q99705 8/20 0.58
HRH3 Q9Y5N1 2/20 0.58
CCR3 P51677 1/20 0.54
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
ALDH1A1 P00352 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
KCNA3 P22001 1/20 0.51

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
SCHEMBL29725628 0.93 SIGMAR1 (0.56) SIGMAR1DRD4MCHR1HRH3CCR3
SCHEMBL27226915 0.88 SIGMAR1 (0.59) SIGMAR1MEN1KMT2AKCNA3
SCHEMBL15021069 0.88 SIGMAR1 (0.59) SIGMAR1MEN1KMT2AKCNA3
SCHEMBL29260128 0.88 KCNA3 (0.53) SIGMAR1MEN1KMT2AKCNA3
SCHEMBL12011091 0.87 KDM4E (0.57) SIGMAR1DRD4MCHR1MEN1KMT2A
SCHEMBL3351581 0.87 SIGMAR1 (0.60) SIGMAR1MCHR1HRH3CCR3KCNA3
SCHEMBL30135707 0.87 KCNA3 (0.52) SIGMAR1MEN1KMT2AKCNA3
SCHEMBL15021685 0.87 SIGMAR1 (0.60) SIGMAR1MEN1KMT2AKCNA3
SCHEMBL915402 0.86 KMT2A (0.65) SIGMAR1DRD4MCHR1MEN1KMT2A
SCHEMBL13088854 0.86 KDM4E (0.53) SIGMAR1MCHR1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11660303-B2 2-phenylimidazo[4,5-b]pyridin-7-amine derivates useful as inhibitors of mammalian tyrosine kinase ROR1 activity KANCERA AB (SE) 2023-05-30 US disclosed
CN-109563092-A It can be used as the 2- phenylimidazole of the active inhibitor of mammal tyrosine kinase ROR1 simultaneously [4,5-B] pyridine -7- amine derivative 坎塞拉有限公司 2019-04-02 CN disclosed
EP-1229025-A1 NOVEL QUINAZOLINE DERIVATIVES Japan Energy Corporation (JP) 2002-08-07 EP disclosed
EP-0111397-B1 ISOINDOLE DERIVATIVES, PREPARATION, AND USES Bristol-Myers Company (US) 1989-03-01 EP disclosed
US-4600758-A 5-SULFAMOYL-3-OXOISOINDOLES WITH ARLYPIPERIDINYL MOIETIES, DIURETICS, HYPOTENSIVES MEAD JOHNSON & COMPANY (US) 1986-07-15 US disclosed
US-4495194-A HYPOTENSIVE AGENTS; DIURETICS MEAD JOHNSON & COMPANY (US) 1985-01-22 US disclosed
EP-0111397-A1 Isoindole derivatives, preparation, and uses Bristol-Myers Company (US) 1984-06-20 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 (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-11660303-B2 2-phenylimidazo[4,5-b]pyridin-7-amine derivates useful as inhibitors of mammalian tyrosine kinase ROR1 activity ROR1, RORB, RORA SIGMAR1 2236/4885DRD4 4664/4885MCHR1 540/4885

“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.