SCHEMBL15475261

SCHEMBL15475261

CN(C(=O)c1cc2cc(OC3CCN(c4ccc(C(F)(F)F)cc4)CC3)ccc2o1)C1CCN(C(=O)O)CC1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LIPE Q05469 1/20 0.38
EPHX2 P34913 1/20 0.38
HRH3 Q9Y5N1 1/20 0.38
PIM1 P11309 2/20 0.37
PIM2 Q9P1W9 1/20 0.37
SLC6A4 P31645 1/20 0.37
FFAR1 O14842 2/20 0.36
MCHR1 Q99705 3/20 0.36
LIPG Q9Y5X9 2/20 0.36
SCN9A Q15858 1/20 0.36
LIPC P11150 1/20 0.36
CHRM4 P08173 1/20 0.36
ADRB2 P07550 1/20 0.36
PDK2 Q15119 1/20 0.36
NOTUM Q6P988 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
SCHEMBL648821 0.91 GPR119 (0.43)
SCHEMBL649872 0.90 ALDH1A1 (0.43) HRH3SCN9AADRB2
SCHEMBL649432 0.89 HRH3 (0.38) HRH3PIM1PIM2SLC6A4FFAR1
SCHEMBL649754 0.89 ADRB2 (0.47) MCHR1CHRM4ADRB2
SCHEMBL4403502 0.87 ADRB2 (0.46) MCHR1CHRM4ADRB2
SCHEMBL649378 0.86 ADRB2 (0.43) MCHR1CHRM4ADRB2
SCHEMBL16927798 0.85 ADRB2 (0.52) ADRB2
SCHEMBL649609 0.84 MAOA (0.48) HRH3FFAR1MCHR1CHRM4ADRB2
SCHEMBL647502 0.83 LMNA (0.45)
SCHEMBL647391 0.83 SLC6A5 (0.44) FFAR1MCHR1CHRM4ADRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9409884-B2 5- or 6-substituted benzofuran-2-carboxamide compounds and methods for using them RIGEL PHARMACEUTICALS, INC. (US) 2016-08-09 US disclosed
US-9174964-B2 AMPK-activating piperidinyloxy-substituted 2,3-dihydro-1H-indene-1-amine compounds and pharmaceutical compositions including the same RIGEL PHARMACEUTICALS, INC. (US) 2015-11-03 US disclosed
US-20140378429-A1 Carboxamide, Sulfonamide and Amine Compounds and Methods for Using Them RIGEL PHARMACEUTICALS, INC. (US) 2014-12-25 US disclosed
US-20140051673-A1 AMPK-Activating Heterocycloalkyloxy(Hetero)Aryl Carboxamide, Sulfonamide And Amine Compounds And Methods For Using The Same RIGEL PHARMACEUTICALS, INC. (US) 2014-02-20 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 (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-20140051673-A1 AMPK-Activating Heterocycloalkyloxy(Hetero)Aryl Carboxamide, Sulfonamide And Amine Compounds And Methods For Using The Same PRKAA1, PRKAA2, PRKAG1 LIPE 1333/4885EPHX2 2193/4885HRH3 3485/4885
US-20140378429-A1 Carboxamide, Sulfonamide and Amine Compounds and Methods for Using Them CPT2, SHMT2, CS LIPE 547/4885EPHX2 2449/4885HRH3 2910/4885

“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.