SCHEMBL2569707

SCHEMBL2569707

CC(C)(C)c1nc(-c2cc(C(=O)NCC(F)(F)F)no2)cn1CC1CCOCC1

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 14/20 0.38
CNR1 P21554 5/20 0.37
BRD4 O60885 1/20 0.36
SCD O00767 1/20 0.36
HIF1A Q16665 1/20 0.35
ALDH1A1 P00352 1/20 0.35
NAPEPLD Q6IQ20 1/20 0.34

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
SCHEMBL3422360 0.85 CNR2 (0.40) CNR2CNR1BRD4SCD
SCHEMBL2570359 0.84 CNR2 (0.38) CNR2CNR1NAPEPLD
SCHEMBL2571794 0.84 CNR2 (0.36) CNR2CNR1BRD4NAPEPLD
SCHEMBL2573341 0.83 CNR2 (0.38) CNR2CNR1
SCHEMBL2567684 0.82 CNR2 (0.39) CNR2CNR1ALDH1A1
SCHEMBL2570972 0.81 MTOR (0.46) CNR2CNR1BRD4
SCHEMBL2570404 0.81 ALDH1A1 (0.40) CNR2CNR1ALDH1A1
SCHEMBL2576760 0.81 NPC1 (0.40) CNR2CNR1SCDALDH1A1
SCHEMBL2571738 0.73 MARK3 (0.39) CNR2CNR1BRD4
SCHEMBL2581268 0.72 BRD4 (0.38) CNR2CNR1BRD4SCD

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 1/4885BRD4 72/4885
US-20100152178-A1 IMIDAZOLE DERIVATIVES CNR1, CNR2, ARRB1 CNR2 2/4885CNR1 1/4885BRD4 72/4885

“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.