SCHEMBL3912899

SCHEMBL3912899

Cc1ccccc1Cn1cncc(-c2ccc(OCc3ccccc3)c(F)c2)c1=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.43
TSHR P16473 3/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
FFAR1 O14842 2/20 0.40
PPARD Q03181 1/20 0.40
S1PR5 Q9H228 1/20 0.40
ERN1 O75460 1/20 0.39
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
MAPK14 Q16539 1/20 0.38
LMNA P02545 2/20 0.38
GRM2 Q14416 1/20 0.38
MET P08581 1/20 0.38
HGF P14210 1/20 0.38
MST1R Q04912 1/20 0.38
MAPT P10636 2/20 0.38
RXFP1 Q9HBX9 2/20 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
SCHEMBL3915575 0.89 GRK2 (0.45) S1PR5ERN1MAPK14METHGF
SCHEMBL3923436 0.89 S1PR5 (0.42) SMN1; SMN2TSHRKMT2AS1PR5ERN1
SCHEMBL3911319 0.88 SCD (0.43) MEN1KMT2AFFAR1PPARDS1PR5
SCHEMBL3911190 0.88 S1PR5 (0.43) FFAR1PPARDS1PR5ERN1MAPK14
SCHEMBL3912908 0.88 MAPK14 (0.43) SMN1; SMN2TSHRFFAR1PPARDS1PR5
SCHEMBL3917605 0.85 CYP11B1 (0.47) SMN1; SMN2TSHRS1PR5CYP3A4CYP2C9
SCHEMBL3917400 0.85 MRGPRX4 (0.43) S1PR5CYP3A4CYP2C9MAPK14GRK2
SCHEMBL3105830 0.85 CYP11B1 (0.44) S1PR5CYP3A4CYP2C9MAPK14GRK2
SCHEMBL3915705 0.84 MEN1 (0.43) SMN1; SMN2MEN1KMT2AS1PR5MAPK14
SCHEMBL3915748 0.84 GRK2 (0.41) S1PR5ERN1MAPK14METHGF

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 SMN1; SMN2 1817/4885TSHR 1695/4885MEN1 853/4885

“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.