SCHEMBL5866816

SCHEMBL5866816

COc1ccccc1-c1cc2cnccc2nc1NC(=O)Nc1ccc(F)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRA P16234 2/20 0.46
KDR P35968 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
FGFR1 P11362 3/20 0.45
PDGFRB P09619 1/20 0.45
SRC P12931 1/20 0.45
HTR2A P28223 2/20 0.45
HTR2C P28335 2/20 0.45
LMNA P02545 5/20 0.44
CYP1A2 P05177 3/20 0.44
CYP3A4 P08684 3/20 0.44
CYP2D6 P10635 2/20 0.44
MAPK1 P28482 2/20 0.44
CYP2C19 P33261 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
KMT2A Q03164 4/20 0.44
MEN1 O00255 3/20 0.44
TAAR1 Q96RJ0 1/20 0.44
MAPT P10636 3/20 0.44
HPGD P15428 1/20 0.44

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
SCHEMBL5749766 0.89 MEN1 (0.51) KDRSMN1; SMN2HTR2AHTR2CLMNA
SCHEMBL5747258 0.86 FGFR1 (0.48) PDGFRASMN1; SMN2FGFR1PDGFRBSRC
SCHEMBL5749184 0.85 ALDH1A1 (0.51) PDGFRAFGFR1PDGFRBSRCHTR2A
SCHEMBL5751015 0.84 FGFR1 (0.63) PDGFRAKDRFGFR1PDGFRBSRC
SCHEMBL5748530 0.84 ABL1 (0.53) PDGFRAKDRFGFR1PDGFRBSRC
SCHEMBL5751620 0.82 ADORA3 (0.47) KDRFGFR1PDGFRBLMNAKMT2A
SCHEMBL5751374 0.81 IMPDH2 (0.48) SMN1; SMN2LMNACYP1A2CYP2C19TDP1
SCHEMBL5746964 0.81 IMPDH2 (0.47) PDGFRASMN1; SMN2FGFR1PDGFRBCYP1A2
SCHEMBL5748516 0.80 IMPDH2 (0.50) SMN1; SMN2FGFR1LMNAKMT2AMEN1
SCHEMBL5749355 0.80 LMNA (0.49) PDGFRASMN1; SMN2FGFR1PDGFRBSRC

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-7005434-B2 Compounds and uses thereof SB CORPORATION (US) 2006-02-28 US disclosed
US-20040048888-A1 Novel compounds and uses thereof SMITHKLINE BEECHAM CORPORATION 2004-03-11 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-20040048888-A1 Novel compounds and uses thereof TEK, TIE1, KDR PDGFRA 8/4885KDR 3/4885SMN1; SMN2 2273/4885

“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.