SCHEMBL657122

SCHEMBL657122

O=C(CCc1ccc(-c2ccccc2)cc1)c1ccccc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 4/20 0.69
RAB9A P51151 3/20 0.61
SMN1; SMN2 Q16637 3/20 0.61
NPC1 O15118 2/20 0.61
TDP1 Q9NUW8 2/20 0.61
LMNA P02545 2/20 0.61
CASP3 P42574 1/20 0.61
SENP8 Q96LD8 1/20 0.61
SENP7 Q9BQF6 1/20 0.61
SENP6 Q9GZR1 1/20 0.61
CYP1A2 P05177 1/20 0.61
HIF1A Q16665 1/20 0.61
MMP12 P39900 1/20 0.61
L3MBTL1 Q9Y468 4/20 0.59
HPGD P15428 1/20 0.59
CES1 P23141 2/20 0.58
NAAA Q02083 1/20 0.54
MAPT P10636 2/20 0.53
NR4A2 P43354 1/20 0.53
PTPN1 P18031 1/20 0.53

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
SCHEMBL24599291 0.96 FFAR1 (0.69) FFAR1RAB9ASMN1; SMN2NPC1TDP1
SCHEMBL656028 0.88 FFAR1 (0.59) FFAR1RAB9ASMN1; SMN2NPC1LMNA
SCHEMBL28251466 0.88 TDP1 (0.77) FFAR1RAB9ASMN1; SMN2NPC1TDP1
SCHEMBL15524969 0.88 TDP1 (0.77) FFAR1RAB9ASMN1; SMN2NPC1TDP1
SCHEMBL30572 0.88 TDP1 (0.77) FFAR1RAB9ASMN1; SMN2NPC1TDP1
Hydrochloric Acid SCHEMBL27556767 0.86 TDP1 (0.74) FFAR1RAB9ASMN1; SMN2NPC1TDP1
SCHEMBL28650296 0.85 RAB9A (0.82) FFAR1RAB9ASMN1; SMN2NPC1LMNA
SCHEMBL1985867 0.85 NPC1 (0.62) FFAR1RAB9ANPC1TDP1LMNA
SCHEMBL1076586 0.85 DPP4 (0.67) FFAR1RAB9ANPC1TDP1LMNA
SCHEMBL4981592 0.84 S1PR4 (0.57) FFAR1RAB9ASMN1; SMN2NPC1LMNA

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
EP-2349999-B1 ALLOSTERIC PROTEIN KINASE MODULATORS UNIV SAARLAND (DE) 2016-01-27 EP disclosed
US-8912186-B2 Allosteric protein kinase modulators UNIVERSITAET DES SAARLANDES (DE) 2014-12-16 US disclosed
US-20120046307-A1 ALLOSTERIC PROTEIN KINASE MODULATORS UNIVERSITAET DES SAARLANDES (DE) 2012-02-23 US disclosed
EP-2177510-A1 Allosteric protein kinase modulators Universität des Saarlandes (DE) 2010-04-21 EP 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-20120046307-A1 ALLOSTERIC PROTEIN KINASE MODULATORS AURKC, AURKA, AURKB FFAR1 4188/4885RAB9A 2902/4885SMN1; SMN2 4389/4885

“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.