SCHEMBL3944819

SCHEMBL3944819

NC(CO)Cc1n[nH]c2c(F)cccc12

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AR P10275 2/20 0.37
▸ SCN9A Q15858 1/20 0.34
▸ MPO P05164 7/20 0.34
▸ SLC6A4 P31645 5/20 0.34
▸ GPR84 Q9NQS5 1/20 0.33
▸ FEN1 P39748 1/20 0.33
▸ EGFR P00533 1/20 0.33
▸ MAP4K4 O95819 1/20 0.32
▸ CSF1R P07333 1/20 0.32
▸ FGFR1 P11362 1/20 0.32
▸ PDGFRA P16234 1/20 0.32
▸ LTK P29376 1/20 0.32
▸ KDR P35968 1/20 0.32
▸ MAPK8 P45983 1/20 0.32
▸ CSNK1A1 P48729 1/20 0.32
▸ LIMK1 P53667 1/20 0.32
▸ CDK5 Q00535 1/20 0.32
▸ ACVR1 Q04771 1/20 0.32
▸ TNK2 Q07912 1/20 0.32
▸ AURKB Q96GD4 1/20 0.32

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
SCHEMBL3934765 0.82 KIF11 (0.39) ARSCN9ACTNNB1WNT3ALMNA
SCHEMBL3944570 0.77 KDR (0.38) GPR84MAP4K4CSF1RFGFR1LTK
SCHEMBL3938749 0.76 ALDH1A1 (0.40) ARSCN9A
SCHEMBL13122355 0.73 AR (0.43) ARMPOSLC6A4GPR84FEN1
SCHEMBL8205528 0.70 AR (0.40) ARMPOSLC6A4GPR84FEN1
SCHEMBL20278780 0.69 L3MBTL1 (0.39) FEN1
SCHEMBL786302 0.69 CHEK1 (0.60) ARMPOSLC6A4GPR84FEN1
SCHEMBL5638323 0.69 AR (0.39) ARMPOSLC6A4GPR84FEN1
SCHEMBL30142257 0.68 MPO (0.42) ARMPOSLC6A4FEN1MAP4K4
SCHEMBL31411334 0.68 TAAR1 (0.44) ARMPOSLC6A4GPR84

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-20090082372-A1 Arylmethylene Substituted N-Acyl-Beta-Amino Alcohols BAYER SCHERING PHARMA AG (DE) 2009-03-26 — — US disclosed
WO-2009013354-A1 ARYLMETHYLENE SUBSTITUTED N-ACYL-β-AMINO ALCOHOLS BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2009-01-29 — — WO 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-20090082372-A1 Arylmethylene Substituted N-Acyl-Beta-Amino Alcohols FSHR, SHBG, NAT1 AR 7/4885SCN9A 1310/4885MPO 3787/4885

“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.

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