SCHEMBL9410285

SCHEMBL9410285

Cc1cccc(C(C)(C)C)c1OCC1CO1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.53
GLA P06280 1/20 0.53
SMN1; SMN2 Q16637 2/20 0.48
KDM4E B2RXH2 1/20 0.48
TSHR P16473 4/20 0.47
TP53 P04637 3/20 0.47
HIF1A Q16665 2/20 0.47
CYP3A4 P08684 1/20 0.47
MAPT P10636 2/20 0.46
HPGD P15428 2/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
CYP1A2 P05177 1/20 0.46
PPARG P37231 1/20 0.46
TDP1 Q9NUW8 1/20 0.45
GAA P10253 2/20 0.44
GABRA1 P14867 1/20 0.40
GABRB2 P47870 1/20 0.40
SCN2A Q99250 2/20 0.36
PKM P14618 2/20 0.36

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
SCHEMBL16828356 0.86 ALDH1A1 (0.55) ALDH1A1GLASMN1; SMN2KDM4ETSHR
SCHEMBL3671560 0.85 ALDH1A1 (0.65) ALDH1A1GLASMN1; SMN2TSHRTP53
SCHEMBL24824294 0.82 ALDH1A1 (0.43) ALDH1A1GLASMN1; SMN2KDM4ETSHR
SCHEMBL731211 0.79 ALDH1A1 (0.72) ALDH1A1GLASMN1; SMN2TSHRTP53
SCHEMBL30033688 0.78 ALDH1A1 (0.65) ALDH1A1GLASMN1; SMN2KDM4ETSHR
SCHEMBL8695311 0.78 ALDH1A1 (0.65) ALDH1A1GLASMN1; SMN2KDM4ETSHR
SCHEMBL80170 0.78 ALDH1A1 (0.65) ALDH1A1GLASMN1; SMN2KDM4ETSHR
SCHEMBL8695675 0.78 ALDH1A1 (0.65) ALDH1A1GLASMN1; SMN2KDM4ETSHR
SCHEMBL18680125 0.78 ALDH1A1 (0.56) ALDH1A1GLASMN1; SMN2TSHRTP53
SCHEMBL11590835 0.78 ALDH1A1 (0.56) ALDH1A1GLASMN1; SMN2KDM4ETSHR

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
WO-2022271338-A1 AMINE-SUBSTITUTED 2-AMINO-ETHAN-1-OLYL POLYMERS, POLYIMIDES, ARTICLES, AND METHODS ESSEX FURUKAWA MAGNET WIRE USA LLC (US) 2022-12-29 WO disclosed
EP-0583971-A1 Piperidine derivatives SANKYO COMPANY LIMITED (JP) 1994-02-23 EP disclosed