SCHEMBL28290500

SCHEMBL28290500

CCC(OCc1ncc[nH]1)N(C)C

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 11/20 0.40
TXN P10599 1/20 0.37
TXNRD1 Q16881 1/20 0.37
HTR1A P08908 1/20 0.36
ALOX15 P16050 1/20 0.35
TERT O14746 1/20 0.33
CYP2D6 P10635 1/20 0.32
TSHR P16473 1/20 0.32
LMNA P02545 1/20 0.31
GLA P06280 1/20 0.31
BLM P54132 1/20 0.31
PMP22 Q01453 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
FDPS P14324 1/20 0.31

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
SCHEMBL12590300 0.75 TAAR1 (0.45) TAAR1TXNTXNRD1HTR1AALOX15
SCHEMBL7270060 0.73 TAAR1 (0.42) TAAR1TXNTXNRD1HTR1AALOX15
SCHEMBL25996725 0.72 TAAR1 (0.46) TAAR1TXNTXNRD1HTR1AALOX15
SCHEMBL28798621 0.71 TAAR1 (0.41) TAAR1TXNTXNRD1HTR1AALOX15
SCHEMBL2908012 0.70
SCHEMBL20564663 0.69 TAAR1 (0.46) TAAR1TXNTXNRD1HTR1AALOX15
SCHEMBL585992 0.69
SCHEMBL11224676 0.68 ALOX15 (0.48) TAAR1HTR1AALOX15TERTSMN1; SMN2
SCHEMBL27404265 0.68 TAAR1 (0.42) TAAR1TXNTXNRD1HTR1AALOX15
SCHEMBL27827138 0.67 TAAR1 (0.41) TAAR1TXNTXNRD1HTR1AALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109563236-A Hardening resin composition and the structural material engagement binder for having used the composition 株式会社ADEKA 2019-04-02 CN disclosed