SCHEMBL10692624

SCHEMBL10692624

Cc1cc(COC(=O)c2ccccc2OCc2cc(C)cc(C(C)(C)C)c2)cc(C(C)(C)C)c1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.47
TACR1 P25103 1/20 0.44
PARP1 P09874 2/20 0.44
AKR1C1 Q04828 1/20 0.44
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
RXFP1 Q9HBX9 1/20 0.41
MAPT P10636 1/20 0.41
KDM4E B2RXH2 1/20 0.41
MRGPRX4 Q96LA9 2/20 0.40
SGMS2 Q8NHU3 1/20 0.40
LMNA P02545 1/20 0.40
PTGER1 P34995 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
SCHEMBL5680244 0.88 HTT (0.55) HTTPARP1AKR1C1MEN1KMT2A
SCHEMBL8425730 0.81 HTT (0.56) HTTPARP1AKR1C1MEN1KMT2A
SCHEMBL8415759 0.79 HTT (0.59) HTTPARP1MEN1KMT2ASMN1; SMN2
SCHEMBL8424385 0.77 HTT (0.46) HTTTACR1PARP1AKR1C1MEN1
Zinc Ion SCHEMBL9784446 0.76 PARP1 (0.51) HTTPARP1AKR1C1MEN1KMT2A
SCHEMBL6044375 0.76 MRGPRX4 (0.51) HTTKMT2AMRGPRX4
SCHEMBL4415350 0.75 HTT (0.75) HTTPARP1MEN1KMT2ASMN1; SMN2
SCHEMBL5680240 0.74 APEX1 (0.58) HTTPARP1AKR1C1MEN1KMT2A
SCHEMBL18719963 0.74 EGFR (0.47) HTTMEN1KMT2ASMN1; SMN2NPSR1
SCHEMBL9574717 0.74 HTT (0.73) HTTPARP1MEN1KMT2ASMN1; SMN2

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-0262810-A2 Sheet recording material containing dye-forming components Fuji Photo Film Co., Ltd. (JP) 1988-04-06 EP disclosed