SCHEMBL3438418

SCHEMBL3438418

C=Cc1ccccc1C=C1CCCCC1=O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.53
HTT P42858 2/20 0.53
HSD11B1 P28845 2/20 0.45
MAPT P10636 7/20 0.42
SMN1; SMN2 Q16637 5/20 0.42
HPGD P15428 3/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
AKR1C3 P42330 1/20 0.42
AKR1C1 Q04828 1/20 0.42
KMT2A Q03164 3/20 0.41
TNF P01375 1/20 0.41
IL6 P05231 1/20 0.41
KDM4E B2RXH2 5/20 0.40
LMNA P02545 3/20 0.40
MEN1 O00255 2/20 0.40
NPSR1 Q6W5P4 1/20 0.39
EGFR P00533 1/20 0.39
HSD17B10 Q99714 2/20 0.38
CYP1A2 P05177 1/20 0.38

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
SCHEMBL3438417 1.00 ALDH1A1 (0.53) ALDH1A1HTTHSD11B1MAPTSMN1; SMN2
SCHEMBL28394403 0.79 ALDH1A1 (0.61) ALDH1A1HTTHSD11B1MAPTSMN1; SMN2
SCHEMBL3438544 0.79 ALDH1A1 (0.53) ALDH1A1HTTHSD11B1MAPTSMN1; SMN2
SCHEMBL3438487 0.79 ALDH1A1 (0.59) ALDH1A1HTTHSD11B1MAPTSMN1; SMN2
SCHEMBL3438488 0.79 IKBKB (0.57) ALDH1A1HTTHSD11B1MAPTSMN1; SMN2
SCHEMBL3438489 0.79 ALDH1A1 (0.59) ALDH1A1HTTHSD11B1MAPTSMN1; SMN2
SCHEMBL3438248 0.79 HSD11B1 (0.72) ALDH1A1HTTHSD11B1MAPTSMN1; SMN2
SCHEMBL3438542 0.79 ALDH1A1 (0.53) ALDH1A1HTTHSD11B1MAPTSMN1; SMN2
SCHEMBL3438486 0.79 IKBKB (0.57) ALDH1A1HTTHSD11B1MAPTSMN1; SMN2
SCHEMBL3438081 0.79 DYRK2 (0.57) ALDH1A1HTTHSD11B1MAPTSMN1; SMN2

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 ALDH1A1 1026/4885HTT 2366/4885HSD11B1 273/4885

“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.