SCHEMBL6735607

SCHEMBL6735607

[CH2]c1cc(C)c(OC)cc1C

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.45
MAPT P10636 4/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
ACHE P22303 2/20 0.37
KDM4E B2RXH2 2/20 0.37
GAA P10253 2/20 0.37
ALDH1A1 P00352 1/20 0.37
GLA P06280 1/20 0.37
CASP1 P29466 1/20 0.37
HSD17B10 Q99714 1/20 0.37
ATM Q13315 1/20 0.36
HTR2A P28223 1/20 0.36
POLB P06746 1/20 0.35
GFER P55789 1/20 0.35

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
SCHEMBL11148284 0.87 ACHE (0.42) TAAR1MAPTMEN1KMT2AACHE
SCHEMBL2954181 0.84 TAAR1 (0.56) TAAR1MAPTSMN1; SMN2MEN1KMT2A
SCHEMBL8269049 0.78 TAAR1 (0.52) TAAR1MAPTSMN1; SMN2MEN1KMT2A
SCHEMBL3677762 0.78 TAAR1 (0.52) TAAR1MAPTSMN1; SMN2MEN1KMT2A
SCHEMBL10718639 0.78 CYP3A4 (0.33) ALDH1A1
SCHEMBL12330214 0.75 TAAR1 (0.48) TAAR1MAPTSMN1; SMN2MEN1KMT2A
SCHEMBL14507701 0.74 TAAR1 (0.48) TAAR1MAPTSMN1; SMN2MEN1KMT2A
SCHEMBL12326171 0.74 TAAR1 (0.48) TAAR1MAPTSMN1; SMN2MEN1KMT2A
Ethylamine SCHEMBL6314624 0.72 TAAR1 (0.63) TAAR1MAPTSMN1; SMN2MEN1KMT2A
Acetonitrile SCHEMBL6315753 0.72 TAAR1 (0.47) TAAR1MAPTSMN1; SMN2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040014764-A1 N-myristoyltransferase inhibitor compositions and methods of use SMITH CHARLES D (US) 2004-01-22 US claimed
US-20040014764-A1 N-myristoyltransferase inhibitor compositions and methods of use SMITH CHARLES D (US) 2004-01-22 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-20040014764-A1 N-myristoyltransferase inhibitor compositions and methods of use NMT2, NMT1, MBOAT1 TAAR1 4563/4885MAPT 133/4885SMN1; SMN2 3958/4885

“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.