SCHEMBL3217142

SCHEMBL3217142

CCc1ccc(-c2ccc(C)c(N)c2)cn1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 1/20 0.45
WDR77 Q9BQA1 1/20 0.45
NTRK1 P04629 1/20 0.42
GRM5 P41594 1/20 0.42
PIK3CA P42336 3/20 0.41
PI4KA P42356 3/20 0.41
PI4KB Q9UBF8 3/20 0.41
PIK3CD O00329 3/20 0.41
PIK3CB P42338 2/20 0.41
PIK3CG P48736 1/20 0.41
ALDH1A1 P00352 4/20 0.40
KDM4E B2RXH2 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
KIT P10721 1/20 0.39
CYP11B1 P15538 1/20 0.39
RAB9A P51151 3/20 0.38
TSHR P16473 2/20 0.38
HSD17B10 Q99714 1/20 0.38
TDP1 Q9NUW8 2/20 0.38
CASP1 P29466 1/20 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
SCHEMBL23643201 0.84 PRMT5 (0.45) PRMT5WDR77PIK3CAPI4KAPI4KB
SCHEMBL26040044 0.80 PRMT5 (0.46) PRMT5WDR77PIK3CAPI4KAPI4KB
SCHEMBL3346814 0.79 PIK3CD (0.51) PRMT5WDR77NTRK1GRM5PIK3CA
SCHEMBL13495562 0.78 GRM5 (0.44) PRMT5WDR77GRM5PIK3CDPIK3CB
SCHEMBL19311825 0.77 GRIN2B (0.47)
SCHEMBL6866139 0.75 CYP3A4 (0.62) NTRK1ALDH1A1KDM4ESMN1; SMN2RAB9A
SCHEMBL31661348 0.75 CYP3A4 (0.62) NTRK1ALDH1A1KDM4ESMN1; SMN2RAB9A
SCHEMBL31436965 0.75 HRH3 (0.42) NTRK1GRM5CYP11B1ABL1FLT3
SCHEMBL12083955 0.71 TAAR1 (0.47) PRMT5WDR77GRM5CYP11B1CYP3A4
SCHEMBL3342185 0.71 TSHR (0.43) ALDH1A1KDM4ESMN1; SMN2RAB9ATSHR

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
WO-2010019930-A1 UREA DERIVATIVES AS INHIBITORS OF MAP KINASES LOCUS PHARMACEUTICALS, INC. (US) 2010-02-18 WO disclosed
US-20100041642-A1 UREA INHIBITORS OF MAP KINASES LOCUS PHARMACEUTICALS, INC. (US) 2010-02-18 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-20100041642-A1 UREA INHIBITORS OF MAP KINASES MAP4K2, MAP3K1, MAP3K20 PRMT5 677/4885WDR77 1371/4885NTRK1 4198/4885

“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.