SCHEMBL2272078

SCHEMBL2272078

CCCCCCC(O)c1cnc(-c2ccc(C(F)(F)F)cc2)nc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 1/20 0.41
RAB9A P51151 3/20 0.41
KDM4E B2RXH2 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
HSD17B10 Q99714 2/20 0.41
MEN1 O00255 1/20 0.41
USP2 O75604 1/20 0.41
ALDH1A1 P00352 1/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
KMT2A Q03164 1/20 0.41
TRPV3 Q8NET8 7/20 0.41
TLR8 Q9NR97 1/20 0.38
PSEN1 P49768 2/20 0.38
PSEN2 P49810 2/20 0.38
APH1B Q8WW43 2/20 0.38
NCSTN Q92542 2/20 0.38
APH1A Q96BI3 2/20 0.38
PSENEN Q9NZ42 2/20 0.38

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
SCHEMBL10200355 0.91 TRPV3 (0.46) ALDH1A1TRPV3PSEN1PSEN2APH1B
SCHEMBL2659430 0.90 HDAC1 (0.41) RARBPSEN1PSEN2APH1BNCSTN
SCHEMBL2271938 0.85 RAB9A (0.43) RAB9AKDM4ESMN1; SMN2ALDH1A1MAPT
SCHEMBL2275196 0.85 RAB9A (0.43) RAB9AKDM4ESMN1; SMN2ALDH1A1MAPT
SCHEMBL2275192 0.85 RAB9A (0.43) RAB9AKDM4ESMN1; SMN2ALDH1A1MAPT
SCHEMBL2274458 0.83 KIF11 (0.42) SMN1; SMN2MEN1KMT2ATLR8PSEN1
SCHEMBL2277014 0.83 KIF11 (0.42) SMN1; SMN2MEN1KMT2ATLR8PSEN1
SCHEMBL2267312 0.83 KIF11 (0.42) SMN1; SMN2MEN1KMT2ATLR8PSEN1
SCHEMBL2274456 0.83 KIF11 (0.42) SMN1; SMN2MEN1KMT2ATLR8PSEN1
SCHEMBL2274452 0.83 KIF11 (0.42) SMN1; SMN2MEN1KMT2ATLR8PSEN1

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
EP-1758859-B1 GLUCAGON RECEPTOR ANTAGONISTS, PREPARATION AND THERAPEUTIC USES LILLY CO ELI (US) 2013-07-17 EP disclosed
US-7989457-B2 Used to treat diabetic and other glucagon related metabolic disorders such as obesity, hyperglycemia, atherosclerosis, ischemic heart disease, stroke, neuropathy, and wound healing; (R,S)-Methanesulfonic acid 2-(3-methyl-4'-trifluoromethyl-biphenyl-4-yl)-propyl ester ELI LILLY AND COMPANY (US) 2011-08-02 US disclosed
US-20080125468-A1 Glucagon Receptor Antagonists, Preparation and Therapeutic Uses ELI LILLY AND COMPANY 2008-05-29 US disclosed
EP-1758859-A1 GLUCAGON RECEPTOR ANTAGONISTS, PREPARATION AND THERAPEUTIC USES ELI LILLY AND COMPANY (US) 2007-03-07 EP disclosed
WO-2005118542-A1 GLUCAGON RECEPTOR ANTAGONISTS, PREPARATION AND THERAPEUTIC USES ELI LILLY AND COMPANY (US) 2005-12-15 WO 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-20080125468-A1 Glucagon Receptor Antagonists, Preparation and Therapeutic Uses GLP1R, GCGR, GIPR RARB 2015/4885RAB9A 1889/4885KDM4E 2271/4885

“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.