SCHEMBL29319606

SCHEMBL29319606

C=C(C)CCC/C=C(\C)COC(C)COC(C)COCc1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.36
CA1 P00915 4/20 0.34
CA2 P00918 2/20 0.34
CA7 P43166 2/20 0.34
CA9 Q16790 2/20 0.34
KMT2A Q03164 1/20 0.34
LSS P48449 1/20 0.34
TACR1 P25103 2/20 0.33
MAPT P10636 1/20 0.33
MAPK1 P28482 1/20 0.32
FAAH O00519 1/20 0.32

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
SCHEMBL2867779 0.83 LSS (0.40) HTTLSSMAPTFAAH
SCHEMBL2867777 0.83 LSS (0.40) HTTLSSMAPTFAAH
SCHEMBL8644381 0.72 TSHR (0.50) HTTCA1CA2CA7CA9
SCHEMBL2781953 0.71 CA1 (0.51) HTTCA1CA2CA7CA9
SCHEMBL2865998 0.70 GPR174 (0.40) KMT2A
SCHEMBL2865999 0.70 GPR174 (0.40) KMT2A
SCHEMBL13535467 0.69 KMT2A (0.50) HTTCA1CA2CA7CA9
SCHEMBL872641 0.69 CA1 (0.53) HTTCA1CA2CA7CA9
SCHEMBL19720285 0.69 KMT2A (0.50) HTTCA1CA2CA7CA9
SCHEMBL2870332 0.69 LSS (0.49) HTTCA1CA2CA7CA9

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
EP-4400914-A2 COMPOSITION FOR FORMING RESIST UNDERLAYER FILM, PATTERNING PROCESS, AND METHOD FOR FORMING RESIST UNDERLAYER FILM SHIN-ETSU CHEMICAL CO., LTD. (JP) 2024-07-17 EP disclosed