SCHEMBL2823672

SCHEMBL2823672

CCOC(=O)c1c(C=Cc2cccc(OC(F)F)c2O)nc2ccccn12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 3/20 0.51
SMN1; SMN2 Q16637 4/20 0.48
CYP1A2 P05177 2/20 0.48
CYP2C9 P11712 2/20 0.48
CYP2C19 P33261 2/20 0.48
ALDH1A1 P00352 4/20 0.42
TSHR P16473 1/20 0.42
RXFP1 Q9HBX9 1/20 0.40
PTGS1 P23219 1/20 0.40
PTGS2 P35354 1/20 0.40
RAB9A P51151 5/20 0.38
NPC1 O15118 3/20 0.38
KDM4E B2RXH2 2/20 0.37
LMNA P02545 1/20 0.37
HTT P42858 1/20 0.37
POLB P06746 1/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 3/20 0.37
HCRTR1 O43613 1/20 0.37
TP53 P04637 1/20 0.37

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
SCHEMBL2823667 1.00 MAPK1 (0.51) MAPK1SMN1; SMN2CYP1A2CYP2C9CYP2C19
SCHEMBL2830607 0.86 MAPK1 (0.46) MAPK1SMN1; SMN2CYP1A2CYP2C9CYP2C19
SCHEMBL2830605 0.86 MAPK1 (0.46) MAPK1SMN1; SMN2CYP1A2CYP2C9CYP2C19
SCHEMBL13935128 0.85 MAPK1 (0.45) MAPK1SMN1; SMN2CYP1A2CYP2C9CYP2C19
SCHEMBL13935129 0.85 MAPK1 (0.45) MAPK1SMN1; SMN2CYP1A2CYP2C9CYP2C19
SCHEMBL2824779 0.85 MAPK1 (0.48) MAPK1SMN1; SMN2ALDH1A1RXFP1RAB9A
SCHEMBL2824778 0.85 MAPK1 (0.48) MAPK1SMN1; SMN2ALDH1A1RXFP1RAB9A
SCHEMBL2822485 0.84 MAPK1 (0.44) MAPK1SMN1; SMN2CYP1A2CYP2C9CYP2C19
SCHEMBL2822488 0.84 MAPK1 (0.44) MAPK1SMN1; SMN2CYP1A2CYP2C9CYP2C19
SCHEMBL2827667 0.76 MAPK1 (0.48) MAPK1SMN1; SMN2CYP1A2CYP2C9CYP2C19

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-8318928-B2 Fused imidazole carboxamides as TRPV3 modulators GLENMARK PHARMACEUTICALS, S.A. (CH) 2012-11-27 US disclosed
US-20100152192-A1 FUSED IMIDAZOLE CARBOXAMIDES AS TRPV3 MODULATORS GLENMARK PHARMACEUTICALS S.A (CH) 2010-06-17 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-20100152192-A1 FUSED IMIDAZOLE CARBOXAMIDES AS TRPV3 MODULATORS TRPV3, TRPV1, TRPV2 MAPK1 2141/4885SMN1; SMN2 3907/4885CYP1A2 1594/4885

“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.