SCHEMBL15499883

SCHEMBL15499883

NNC(=O)c1nc(C2CCCCCCCCCCCCCC2)cs1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RORC P51449 1/20 0.42
TYR P14679 1/20 0.41
TMIGD3 P0DMS9 3/20 0.40
ADORA1 P30542 3/20 0.40
IDO1 P14902 1/20 0.38
C1S P09871 1/20 0.38
CNR2 P34972 5/20 0.37
ATR Q13535 1/20 0.37
KDM1A O60341 1/20 0.37
ADORA2A P29274 1/20 0.36
POLB P06746 1/20 0.36
CNR1 P21554 1/20 0.36
CBLB Q13191 1/20 0.36
RAB9A P51151 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
SCHEMBL18811614 1.00 RORC (0.42) RORCTYRTMIGD3ADORA1IDO1
SCHEMBL20389483 1.00 RORC (0.42) RORCTYRTMIGD3ADORA1IDO1
SCHEMBL22518536 0.92 ADORA1 (0.47) TYRTMIGD3ADORA1KDM1AADORA2A
SCHEMBL3708334 0.86 C1S (0.42) RORCTYRTMIGD3ADORA1IDO1
SCHEMBL4769460 0.84 TMIGD3 (0.41) RORCTYRTMIGD3ADORA1IDO1
SCHEMBL31135495 0.81 ADORA1 (0.41) RORCTMIGD3ADORA1IDO1C1S
SCHEMBL20389484 0.79 TYR (0.40) RORCTYRTMIGD3ADORA1IDO1
SCHEMBL2678119 0.77 ADORA1 (0.46) TMIGD3ADORA1C1SADORA2ACBLB
SCHEMBL14811149 0.76 TMIGD3 (0.38) RORCTYRTMIGD3ADORA1IDO1
SCHEMBL18811612 0.75 SMN1; SMN2 (0.49) RORCTMIGD3ADORA1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9018380-B2 Heterocyclic modulators of HIF activity for treatment of disease Boar of Regents, The University of Texas System (US) 2015-04-28 US disclosed
US-20140066424-A1 HETEROCYCLIC MODULATORS OF HIF ACTIVITY FOR TREATMENT OF DISEASE Institute For Applied Cancer Science/The University of Texas MD Anderson Cancer Center (US) 2014-03-06 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 (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-20140066424-A1 HETEROCYCLIC MODULATORS OF HIF ACTIVITY FOR TREATMENT OF DISEASE HIF1AN, HIF1A, EGLN3 RORC 1343/4885TYR 3834/4885TMIGD3 3847/4885

“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.