Propane

Propane

SCHEMBL8983786

CC.CCC.FC(F)(F)COCc1ccccc1.OP(O)(O)=S.OP(O)(O)=S

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.50
KDM4E B2RXH2 1/20 0.45
POLB P06746 1/20 0.45
TSHR P16473 2/20 0.42
TACR1 P25103 1/20 0.41
PTPN1 P18031 2/20 0.38
PTPN2 P17706 1/20 0.38
PTPN6 P29350 1/20 0.38
CA1 P00915 1/20 0.37
CETP P11597 3/20 0.37
MAPT P10636 1/20 0.36
MEN1 O00255 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C19 P33261 1/20 0.36
KMT2A Q03164 1/20 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
SCHEMBL8157722 0.83 ALDH1A1 (0.61) ALDH1A1KDM4EPOLBTSHRTACR1
SCHEMBL8743578 0.74 TSHR (0.54) ALDH1A1KDM4EPOLBTSHRTACR1
SCHEMBL5349731 0.73 TSHR (0.52) ALDH1A1KDM4EPOLBTSHRTACR1
SCHEMBL23227891 0.73 TSHR (0.52) ALDH1A1KDM4EPOLBTSHRTACR1
SCHEMBL4860052 0.73 TSHR (0.52) ALDH1A1KDM4EPOLBTSHRTACR1
SCHEMBL18640775 0.72 TSHR (0.56) ALDH1A1KDM4EPOLBTSHRTACR1
Propane SCHEMBL11584021 0.71 TSHR (0.83) ALDH1A1KDM4EPOLBTSHRTACR1
SCHEMBL9544613 0.70 KDM4E (0.50) ALDH1A1KDM4EPOLBTSHRTACR1
SCHEMBL8983816 0.70 ALDH1A1 (0.65) ALDH1A1MAPTMEN1CYP3A4CYP2C19
SCHEMBL476765 0.69 KDM4E (0.53) ALDH1A1KDM4EPOLBTSHRTACR1

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
EP-0504902-B1 Phosphoric acid ester derivatives, process for preparing the derivative and insecticidal and miticidal composition comprising the derivative OTSUKA KAGAKU KK (JP) 1996-06-05 EP disclosed
EP-0504902-A1 Phosphoric acid ester derivatives, process for preparing the derivative and insecticidal and miticidal composition comprising the derivative OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 1992-09-23 EP disclosed