SCHEMBL4059055

SCHEMBL4059055

CCCCCc1ccc2c(OCCOCC)cccc2c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1B P28222 5/20 0.44
NCF1 P14598 2/20 0.43
HTR1D P28221 2/20 0.42
MAPK1 P28482 3/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
USP2 O75604 2/20 0.41
ALDH1A1 P00352 2/20 0.41
LMNA P02545 1/20 0.41
CYP3A4 P08684 1/20 0.41
CASP1 P29466 1/20 0.41
SLCO1B3 Q9NPD5 1/20 0.41
SLCO1B1 Q9Y6L6 1/20 0.41
HTT P42858 3/20 0.41
MAPT P10636 2/20 0.41
APAF1 O14727 1/20 0.41
THRB P10828 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
SLC6A4 P31645 2/20 0.41

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
SCHEMBL15779727 0.80 PPARA (0.51) S1PR1S1PR3
SCHEMBL14613949 0.78 NCEH1 (0.42) HTR1BHTR1DALDH1A1
SCHEMBL4059998 0.76 HTR1B (0.61) HTR1BNCF1HTR1DMEN1KMT2A
SCHEMBL28009344 0.75 S1PR1 (0.44) MAPTS1PR1S1PR3
SCHEMBL21633627 0.75 NCF1 (0.51) HTR1BNCF1HTR1DMEN1KMT2A
SCHEMBL181330 0.74 PPARG (0.53) S1PR1S1PR3
SCHEMBL28082844 0.74 KDM4E (0.61) HTR1BNCF1HTR1DMEN1KMT2A
SCHEMBL249286 0.74 KCNA3 (0.55) HTR1BHTR1DSLC6A4MCHR1
SCHEMBL29447160 0.73 KCNA3 (0.54) HTR1BHTR1DLMNACYP3A4MAPT
SCHEMBL11852540 0.73 CYP1A2 (0.50) ALDH1A1LMNACYP3A4SLC6A4S1PR1

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-7534547-B2 Optically active compound and photosensitive resin composition OSAKA GAS COMPANY LIMITED (JP) 2009-05-19 US disclosed
EP-1375463-A1 OPTICALLY ACTIVE COMPOUND AND PHOTOSENSITIVE RESIN COMPOSITION Kansai Research Institute, Inc. (JP) 2004-01-02 EP disclosed
US-20030211421-A1 Optically active compound and photosensitive resin composition KRI, INC. (JP) 2003-11-13 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030211421-A1 Optically active compound and photosensitive resin composition ARCN1, RAD51, PAM HTR1B 693/4885NCF1 632/4885HTR1D 285/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.