SCHEMBL2570359

SCHEMBL2570359

CC(C)(C)c1nc(-c2cccc(C(=O)NCC(F)(F)F)n2)cn1CC1CCOCC1

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 9/20 0.38
CNR1 P21554 1/20 0.37
ULK1 O75385 1/20 0.37
HTR4 Q13639 2/20 0.36
NAPEPLD Q6IQ20 1/20 0.36
IRAK4 Q9NWZ3 5/20 0.36
IL1B P01584 1/20 0.35
P2RX7 Q99572 1/20 0.35
GLS O94925 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
SCHEMBL2571794 0.88 CNR2 (0.36) CNR2CNR1HTR4NAPEPLD
SCHEMBL2570972 0.85 MTOR (0.46) CNR2CNR1ULK1
SCHEMBL2569707 0.84 CNR2 (0.38) CNR2CNR1NAPEPLD
SCHEMBL2570807 0.82 CNR2 (0.39) CNR2CNR1
SCHEMBL3417909 0.81 CNR2 (0.39) CNR2CNR1
SCHEMBL2572007 0.79 CNR2 (0.39) CNR2CNR1
SCHEMBL2569941 0.77 CNR2 (0.40) CNR2CNR1
SCHEMBL2581268 0.76 BRD4 (0.38) CNR2CNR1IRAK4
SCHEMBL2572712 0.75 BRD4 (0.43) CNR2CNR1
SCHEMBL2571131 0.74 MTOR (0.45) CNR2CNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120289502-A1 IMIDAZOLE DERIVATIVES KYOWA HAKKO KIRIN CO., LTD. (JP) 2012-11-15 US disclosed
US-8273738-B2 Imidazole derivatives KYOWA HAKKO KIRIN CO., LTD. (JP) 2012-09-25 US disclosed
EP-2090570-B1 IMIDAZOLE DERIVATIVE KYOWA HAKKO KIRIN CO LTD (JP) 2011-11-09 EP disclosed
US-20100152178-A1 IMIDAZOLE DERIVATIVES KYOWA HAKKO KIRIN CO., LTD. (JP) 2010-06-17 US disclosed
EP-2090570-A1 IMIDAZOLE DERIVATIVE Kyowa Hakko Kirin Co., Ltd. (JP) 2009-08-19 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 (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-20120289502-A1 IMIDAZOLE DERIVATIVES CNR1, CNR2, ARRB1 CNR2 2/4885CNR1 1/4885ULK1 553/4885
US-20100152178-A1 IMIDAZOLE DERIVATIVES CNR1, CNR2, ARRB1 CNR2 2/4885CNR1 1/4885ULK1 553/4885

“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.