SCHEMBL5374646

SCHEMBL5374646

Cc1cc(O)c(C(C)(C)C)cc1C1CCCCC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 5/20 0.46
ALDH1A1 P00352 4/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
TP53 P04637 3/20 0.46
CYP3A4 P08684 2/20 0.46
TSHR P16473 1/20 0.46
MAPK1 P28482 1/20 0.46
HIF1A Q16665 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
CYP1A2 P05177 3/20 0.45
KDM4E B2RXH2 1/20 0.45
MAPT P10636 1/20 0.45
ATP2A2 P16615 1/20 0.45
ATP2A3 Q93084 1/20 0.45
CYP2C9 P11712 4/20 0.40
CYP2C19 P33261 3/20 0.40
CYP2D6 P10635 2/20 0.40
ATM Q13315 1/20 0.38
CNR1 P21554 4/20 0.38
LMNA P02545 2/20 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
SCHEMBL27411644 0.87 NUDT1 (0.39) ALOX15ALDH1A1SMN1; SMN2TP53CYP3A4
SCHEMBL7759772 0.83 ALOX15 (0.54) ALOX15ALDH1A1SMN1; SMN2TP53CYP3A4
SCHEMBL14991185 0.81 ALDH1A1 (0.38) ALOX15ALDH1A1TSHRTDP1MAPT
SCHEMBL1243063 0.80 KDM4E (0.41) ALOX15ALDH1A1CYP3A4MAPK1HIF1A
SCHEMBL1186506 0.80 NUDT1 (0.44) KDM4EMAPTCNR1NUDT1BACE1
SCHEMBL3826625 0.80 ESR2 (0.46) ALOX15ALDH1A1SMN1; SMN2TP53CYP3A4
SCHEMBL30104451 0.80 NUDT1 (0.39) ALOX15ALDH1A1SMN1; SMN2TP53CYP3A4
SCHEMBL10385924 0.78 NUDT1 (0.41) ALOX15ALDH1A1CYP3A4MAPK1HIF1A
SCHEMBL18272081 0.77 ALDH1A1 (0.42) ALOX15ALDH1A1SMN1; SMN2TP53CYP3A4
SCHEMBL9785309 0.77 NUDT1 (0.44) KDM4EMAPTCNR1NUDT1BACE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7202323-B2 Polycarbonate resin MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2007-04-10 US disclosed
US-6872858-B2 Diphenol and process for producing the same HONSHU CHEMICAL INDUSTRY CO., LTD. (JP) 2005-03-29 US disclosed
EP-1477507-A1 Polycarbonate resin MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2004-11-17 EP disclosed
US-20040049086-A1 Diphenol and process for producing the same HONSHU CHEMICAL INDUSTRY CO., LTD. (JP) 2004-03-11 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-20040049086-A1 Diphenol and process for producing the same CYP1A1, AHR, CYP2E1 ALOX15 659/4885ALDH1A1 1259/4885SMN1; SMN2 4761/4885

“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.