SCHEMBL3438451

SCHEMBL3438451

CCCCCCOc1ccc(C=C2CCCCC2=O)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.50
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
HPGD P15428 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
EGFR P00533 1/20 0.47
AKR1C3 P42330 1/20 0.47
AKR1C1 Q04828 1/20 0.47
LTA4H P09960 1/20 0.46
ALDH1A1 P00352 2/20 0.45
HTT P42858 1/20 0.45
NR5A1 Q13285 1/20 0.45
LMNA P02545 1/20 0.45
PIM1 P11309 1/20 0.45
PIM2 Q9P1W9 1/20 0.45
KDM4E B2RXH2 1/20 0.45
MAPK1 P28482 1/20 0.45
CYP1A2 P05177 1/20 0.44
TP53 P04637 1/20 0.44
TSHR P16473 1/20 0.44

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
SCHEMBL3438449 1.00 MAPT (0.50) MAPTNPC1RAB9AHPGDSMN1; SMN2
SCHEMBL3438479 0.96 MAPT (0.54) MAPTNPC1RAB9AHPGDSMN1; SMN2
SCHEMBL3438075 0.90 PIM1 (0.55) MAPTNPC1RAB9AHPGDSMN1; SMN2
SCHEMBL5585137 0.88 CYP1A2 (0.60) MAPTNPC1RAB9ASMN1; SMN2EGFR
SCHEMBL5585133 0.88 CYP1A2 (0.60) MAPTNPC1RAB9ASMN1; SMN2EGFR
SCHEMBL14473090 0.88 CYP1A2 (0.60) MAPTNPC1RAB9ASMN1; SMN2EGFR
SCHEMBL1524740 0.87 PIM1 (0.55) MAPTNPC1RAB9AHPGDSMN1; SMN2
SCHEMBL1524739 0.87 PIM1 (0.55) MAPTNPC1RAB9AHPGDSMN1; SMN2
SCHEMBL3438036 0.85 EGFR (0.49) EGFRALDH1A1HTTTSHR
SCHEMBL3438037 0.85 EGFR (0.49) EGFRALDH1A1HTTTSHR

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-7807856-B2 Process for production of 2-Benzylphenol compound IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 2010-10-05 US disclosed
US-20080194882-A1 Process For Production of 2-Benzylphenol Compound IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 2008-08-14 US disclosed
EP-1810957-A1 METHOD FOR PRODUCING 2-BENZYLPHENOL COMPOUND Ihara Chemical Industry Co., Ltd. (JP) 2007-07-25 EP 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-20080194882-A1 Process For Production of 2-Benzylphenol Compound CYP1B1, CYP4B1, CYP1A1 MAPT 4506/4885NPC1 4280/4885RAB9A 1012/4885

“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.