SCHEMBL3915705

SCHEMBL3915705

O=c1c(-c2ccc(OCc3ccccc3)c(F)c2)cncn1Cc1ccc(F)cc1Cl

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
TP53 P04637 1/20 0.39
MAPK14 Q16539 4/20 0.39
GALR3 O60755 1/20 0.38
NR2F2 P24468 1/20 0.38
FEN1 P39748 1/20 0.38
S1PR5 Q9H228 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
GRK2 P25098 2/20 0.37
ALDH1A1 P00352 1/20 0.37
HTT P42858 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
PTGER1 P34995 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
SCHEMBL3923436 0.92 S1PR5 (0.42) KMT2AMAPK14S1PR5GRK2ALDH1A1
SCHEMBL3917605 0.89 CYP11B1 (0.47) MAPK14FEN1S1PR5GRK2ALDH1A1
SCHEMBL3915575 0.89 GRK2 (0.45) MAPK14FEN1S1PR5GRK2
SCHEMBL3917400 0.88 MRGPRX4 (0.43) MAPK14S1PR5GRK2PTGER1
SCHEMBL3105830 0.86 CYP11B1 (0.44) MAPK14S1PR5GRK2PTGER1
SCHEMBL3923475 0.85 S1PR5 (0.47) MAPK14S1PR5GRK2SMN1; SMN2PTGER1
SCHEMBL3922800 0.84 MRGPRX4 (0.40) MAPK14S1PR5GRK2PTGER1
SCHEMBL3912899 0.84 SMN1; SMN2 (0.43) MEN1KMT2AMAPK14S1PR5GRK2
SCHEMBL3916324 0.84 SMN1; SMN2 (0.44) TP53MAPK14S1PR5GRK2ALDH1A1
SCHEMBL3915748 0.83 GRK2 (0.41) MAPK14FEN1S1PR5GRK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110053931-A1 QUINOLINE COMPOUNDS AND METHODS OF USE GAUDINO JOHN 2011-03-03 US disclosed
EP-2032538-A2 QUINOLINE COMPOUNDS AND METHODS OF USE Array Biopharma, Inc. (US) 2009-03-11 EP disclosed
WO-2007146824-A2 QUINOLINE COMPOUNDS AND METHODS OF USE ARRAY BIOPHARMA INC. (US) 2007-12-21 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-20110053931-A1 QUINOLINE COMPOUNDS AND METHODS OF USE TK1, ABL1, ROR1 MEN1 853/4885KMT2A 3205/4885TP53 31/4885

“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.