SCHEMBL6005149

SCHEMBL6005149

Cc1[nH]nc(-c2ccc(F)cc2)c1-c1nc(C(=O)NCC2CC2)cs1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.45
TLR7 Q9NYK1 1/20 0.41
USP30 Q70CQ3 1/20 0.41
MAPK1 P28482 3/20 0.41
GABRA5 P31644 3/20 0.40
PREP P48147 1/20 0.40
FAP Q12884 1/20 0.40
MAPK14 Q16539 2/20 0.39
TGFBR1 P36897 1/20 0.39
ACKR3 P25106 1/20 0.37
NPC1 O15118 1/20 0.37
POLB P06746 1/20 0.37
RAB9A P51151 1/20 0.37
PIM1 P11309 1/20 0.37
PIM3 Q86V86 1/20 0.37
PIM2 Q9P1W9 1/20 0.37
ROCK1 Q13464 1/20 0.37
NPY5R Q15761 1/20 0.37
KCNH2 Q12809 1/20 0.37
MAPK11 Q15759 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
SCHEMBL6002714 0.87 TLR7 (0.45) CNR1TLR7MAPK1PREPFAP
SCHEMBL4761470 0.85 MAPK11 (0.52) CNR1TLR7USP30MAPK1PREP
SCHEMBL6004529 0.85 TLR7 (0.43) TLR7PREPFAPTGFBR1NPC1
SCHEMBL4821126 0.81 ALDH1A1 (0.51) TLR7ROCK1
SCHEMBL4761409 0.76 MAPK11 (0.52) TLR7MAPK1PREPFAPMAPK14
SCHEMBL4718804 0.75 HAO2 (0.39) TLR7MAPK14TGFBR1NPC1POLB
SCHEMBL4761674 0.75 MAPK11 (0.51) TLR7PREPFAPMAPK14TGFBR1
SCHEMBL4830402 0.74 MAPK11 (0.50) TLR7USP30PREPFAPMAPK14
SCHEMBL6004539 0.73 MAPK11 (0.51) TLR7PREPFAPMAPK14ACKR3
SCHEMBL6003915 0.72 MAPK11 (0.51) TLR7PREPFAPMAPK14TGFBR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060252807-A1 Novel ortho-terphenyl inhibitors of p38 kinase and methods of treating inflammatory disorders KALYPSYS, INC. 2006-11-09 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-20060252807-A1 Novel ortho-terphenyl inhibitors of p38 kinase and methods of treating inflammatory disorders MAPK1, MAP3K1, MAPK4 CNR1 3707/4885TLR7 495/4885USP30 1591/4885

“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.