SCHEMBL9973798

SCHEMBL9973798

CCC(C)Nc1ccc(C)cc1C

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.47
SMN1; SMN2 Q16637 4/20 0.47
L3MBTL1 Q9Y468 3/20 0.47
CYP3A4 P08684 2/20 0.47
TDP1 Q9NUW8 2/20 0.47
TP53 P04637 1/20 0.47
HSP90AA1 P07900 1/20 0.47
THRB P10828 1/20 0.47
ALOX15 P16050 1/20 0.47
TSHR P16473 1/20 0.47
CASP1 P29466 1/20 0.47
HIF1A Q16665 1/20 0.47
HSD17B10 Q99714 1/20 0.47
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
RAPGEF4 Q8WZA2 1/20 0.46
HTT P42858 1/20 0.42
HCAR3 P49019 1/20 0.41
LMNA P02545 1/20 0.41
CYP1A2 P05177 1/20 0.40

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
SCHEMBL11693372 0.85 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2L3MBTL1CYP3A4TDP1
SCHEMBL5074351 0.83 CYP3A4 (0.61) ALDH1A1SMN1; SMN2L3MBTL1CYP3A4TDP1
SCHEMBL11351786 0.82 SMN1; SMN2 (0.47) ALDH1A1SMN1; SMN2L3MBTL1TP53MEN1
SCHEMBL21282795 0.82 SMN1; SMN2 (0.41) ALDH1A1SMN1; SMN2L3MBTL1TDP1MEN1
SCHEMBL18930263 0.81 SMN1; SMN2 (0.44) ALDH1A1SMN1; SMN2L3MBTL1CYP3A4TDP1
SCHEMBL10249395 0.81 ALDH1A1 (0.44) ALDH1A1SMN1; SMN2L3MBTL1CYP3A4TDP1
SCHEMBL1251762 0.81 ALDH1A1 (0.44) ALDH1A1SMN1; SMN2L3MBTL1CYP3A4TDP1
SCHEMBL19417920 0.81 ALDH1A1 (0.44) ALDH1A1SMN1; SMN2L3MBTL1CYP3A4TDP1
SCHEMBL22059426 0.80 KMT2A (0.42) ALDH1A1SMN1; SMN2L3MBTL1TP53THRB
SCHEMBL10037099 0.79 RAPGEF4 (0.52) ALDH1A1SMN1; SMN2L3MBTL1TDP1MEN1

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-20230236500-A1 PHOTOSENSITIVE RESIN COMPOSITION, PHOTOSENSITIVE RESIN FILM USING SAME, COLOR FILTER, AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2023-07-27 US disclosed
EP-2203442-B1 SUBSTITUTED PYRROLO-PYRIMIDINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES SRL (IT) 2012-06-20 EP disclosed