SCHEMBL25554245

SCHEMBL25554245

Cn1nc(C2CCC2)cc1Oc1cc(C#N)ccc1-c1ncc(CCN)cn1

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FEN1 P39748 7/20 0.35
ALOX5AP P20292 6/20 0.35
PTH1R Q03431 4/20 0.33
CYP11B1 P15538 4/20 0.33
CYP11B2 P19099 4/20 0.33
CYP19A1 P11511 2/20 0.33
AXL P30530 1/20 0.32
TYRO3 Q06418 1/20 0.32
MERTK Q12866 1/20 0.32
KDM1A O60341 1/20 0.31
CCNT1 O60563 1/20 0.31
CDK9 P50750 1/20 0.31
NSD2 O96028 1/20 0.31
GPR119 Q8TDV5 1/20 0.30

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
SCHEMBL30257409 1.00 FEN1 (0.35) FEN1ALOX5APPTH1RCYP11B1CYP11B2
SCHEMBL25554463 0.98 PTH1R (0.35) FEN1ALOX5APPTH1RCYP11B1CYP11B2
SCHEMBL30257537 0.96 CYP19A1 (0.34) FEN1ALOX5APPTH1RCYP11B1CYP11B2
SCHEMBL25554329 0.96 CYP19A1 (0.34) FEN1ALOX5APPTH1RCYP11B1CYP11B2
SCHEMBL25058332 0.92 PDE2A (0.34) CYP11B1CYP11B2CYP19A1AXLTYRO3
SCHEMBL30257482 0.90 FEN1 (0.36) FEN1ALOX5APPTH1RCYP11B1CYP11B2
SCHEMBL25554184 0.90 FEN1 (0.36) FEN1ALOX5APPTH1RCYP11B1CYP11B2
SCHEMBL25554675 0.89 LRRK2 (0.34) CYP11B1CYP11B2CYP19A1
SCHEMBL30353054 0.89 NSD2 (0.35) FEN1ALOX5APCYP11B1CYP11B2CYP19A1
SCHEMBL25554344 0.89 NSD2 (0.35) FEN1ALOX5APCYP11B1CYP11B2CYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115996910-A Aryl or heteroaryl derivatives 帝人制药株式会社 2023-04-21 CN claimed
US-20230167073-A1 ARYL OR HETEROARYL DERIVATIVE TEIJIN PHARMA LIMITED (JP) 2023-06-01 US disclosed
US-20230167073-A1 ARYL OR HETEROARYL DERIVATIVE TEIJIN PHARMA LIMITED (JP) 2023-06-01 US disclosed
CN-115996910-A Aryl or heteroaryl derivatives 帝人制药株式会社 2023-04-21 CN 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-20230167073-A1 ARYL OR HETEROARYL DERIVATIVE ARRB1, NR3C2, TRPC6 FEN1 4669/4885ALOX5AP 4203/4885PTH1R 4541/4885

“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.