SCHEMBL3438519

SCHEMBL3438519

CCOc1ccc(/C=C2/CCCCC2=O)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.59
NPC1 O15118 4/20 0.59
MAPT P10636 4/20 0.56
SMN1; SMN2 Q16637 3/20 0.56
HPGD P15428 2/20 0.56
KDM4E B2RXH2 1/20 0.56
CASP3 P42574 1/20 0.56
SENP8 Q96LD8 1/20 0.56
SENP7 Q9BQF6 1/20 0.56
SENP6 Q9GZR1 1/20 0.56
AKR1C3 P42330 1/20 0.53
AKR1C1 Q04828 1/20 0.53
EGFR P00533 2/20 0.53
PIM1 P11309 1/20 0.52
PIM2 Q9P1W9 1/20 0.52
ALDH1A1 P00352 2/20 0.51
HTT P42858 1/20 0.51
CYP1A2 P05177 1/20 0.50
CES2 O00748 1/20 0.49
BCHE P06276 1/20 0.47

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
SCHEMBL3438520 1.00 RAB9A (0.59) RAB9ANPC1MAPTSMN1; SMN2HPGD
SCHEMBL1524435 0.97 RAB9A (0.59) RAB9ANPC1MAPTSMN1; SMN2HPGD
SCHEMBL1524436 0.97 RAB9A (0.59) RAB9ANPC1MAPTSMN1; SMN2HPGD
SCHEMBL3438075 0.88 PIM1 (0.55) RAB9ANPC1MAPTSMN1; SMN2HPGD
SCHEMBL3438479 0.88 MAPT (0.54) RAB9ANPC1MAPTSMN1; SMN2HPGD
SCHEMBL9619547 0.86 CYP1A2 (0.69) RAB9ANPC1MAPTSMN1; SMN2HPGD
SCHEMBL1524740 0.85 PIM1 (0.55) RAB9ANPC1MAPTSMN1; SMN2HPGD
SCHEMBL1524739 0.85 PIM1 (0.55) RAB9ANPC1MAPTSMN1; SMN2HPGD
SCHEMBL3438449 0.84 MAPT (0.50) RAB9ANPC1MAPTSMN1; SMN2HPGD
SCHEMBL3438451 0.84 MAPT (0.50) RAB9ANPC1MAPTSMN1; SMN2HPGD

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 RAB9A 1012/4885NPC1 4280/4885MAPT 4506/4885

“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.