SCHEMBL9718669

SCHEMBL9718669

O=C(c1ccccc1)C1(c2ccccc2)COC2(CCCCC2)O1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1C1 Q04828 1/20 0.39
HDAC4 P56524 2/20 0.38
LMNA P02545 2/20 0.38
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NPSR1 Q6W5P4 3/20 0.36
ALDH1A1 P00352 3/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
GRIN2D O15399 1/20 0.34
GRIN3B O60391 1/20 0.34
CYP2B6 P20813 1/20 0.34
SLC6A2 P23975 1/20 0.34
SLC6A4 P31645 1/20 0.34
PRCP P42785 1/20 0.34
SLC6A3 Q01959 1/20 0.34
GRIN1 Q05586 1/20 0.34
KCNH2 Q12809 1/20 0.34
GRIN2A Q12879 1/20 0.34

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
SCHEMBL10528811 0.81 GLS (0.42) LMNAMEN1KMT2ACYP1A2SLC6A2
SCHEMBL14453309 0.79 LMNA (0.35) AKR1C1LMNAALDH1A1OPRM1TSHR
SCHEMBL9004647 0.78 ALDH1A1 (0.36) LMNAMEN1KMT2ASMN1; SMN2NPSR1
SCHEMBL9314611 0.78 ALDH1A1 (0.36) LMNAMEN1KMT2ASMN1; SMN2NPSR1
SCHEMBL8765171 0.78 LMNA (0.41) AKR1C1HDAC4LMNAMEN1KMT2A
SCHEMBL11611329 0.77 LMNA (0.36) LMNAMEN1KMT2ASMN1; SMN2CYP1A2
SCHEMBL9004904 0.77 LMNA (0.36) AKR1C1LMNAMEN1KMT2ANPSR1
SCHEMBL11491382 0.73 LMNA (0.38) LMNAKMT2ACYP1A2SLC6A2SLC6A4
SCHEMBL9718810 0.73 LMNA (0.34) AKR1C1LMNAKMT2ASMN1; SMN2NPSR1
SCHEMBL6326779 0.71 LMNA (0.36) AKR1C1LMNASMN1; SMN2ALDH1A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5147901-A PROPIONPHENONE DERIVATIVES AS PHOTOINITIATORS FOR PHOTOPOLYMERIZATION CIBA-GEIGY CORPORATION (US) 1992-09-15 US disclosed
US-4795766-A OF ETHYLENICALLY UNSATURATED COMPOUNDS; PRINTING INK CIBA-GEIGY CORPORATION (US) 1989-01-03 US disclosed
EP-0108037-A2 Propiophenone derivatives as photoinitiators in the photopolymerization CIBA-GEIGY AG (CH) 1984-05-09 EP disclosed