SCHEMBL5934501

SCHEMBL5934501

O=C(Nc1ccc(N2CCOCC2)cc1)c1ccc(-c2ccccc2)nc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.68
▸ MCHR1 Q99705 1/20 0.66
▸ TP53 P04637 2/20 0.63
▸ SMN1; SMN2 Q16637 1/20 0.63
▸ DGAT1 O75907 2/20 0.61
▸ HDAC8 Q9BY41 1/20 0.59
▸ HDAC6 Q9UBN7 1/20 0.59
▸ MEN1 O00255 1/20 0.59
▸ KMT2A Q03164 1/20 0.59
▸ ATR Q13535 1/20 0.59
▸ NPC1 O15118 2/20 0.58
▸ RAB9A P51151 2/20 0.58
▸ ATM Q13315 1/20 0.58
▸ PKM P14618 1/20 0.58
▸ MAPK1 P28482 1/20 0.58
▸ WNT3A P56704 4/20 0.58
▸ LMNA P02545 1/20 0.56
▸ HPGDS O60760 1/20 0.56
▸ PTPN2 P17706 1/20 0.55
▸ PTPN1 P18031 1/20 0.55

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
SCHEMBL5934542 0.87 MAPT (0.61) MAPTMCHR1TP53SMN1; SMN2DGAT1
SCHEMBL5934197 0.86 ALDH1A1 (0.74) MAPTMCHR1TP53SMN1; SMN2DGAT1
SCHEMBL5934510 0.86 MAPT (0.64) MAPTMCHR1TP53SMN1; SMN2DGAT1
SCHEMBL6186877 0.85 LMNA (0.62) MAPTMCHR1TP53SMN1; SMN2DGAT1
SCHEMBL5934277 0.85 MAPT (0.63) MAPTTP53SMN1; SMN2HDAC8HDAC6
SCHEMBL5934212 0.85 MAPT (0.69) MAPTTP53SMN1; SMN2DGAT1HDAC8
SCHEMBL5934793 0.85 MAPT (0.63) MAPTMCHR1TP53SMN1; SMN2DGAT1
SCHEMBL14082219 0.84 MAPT (0.65) MAPTTP53SMN1; SMN2DGAT1HDAC8
SCHEMBL5934266 0.84 MAPT (0.62) MAPTTP53SMN1; SMN2DGAT1HDAC8
SCHEMBL5934460 0.82 MAPT (0.61) MAPTTP53SMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060100245-A1 Substituted biphenyl-4-carboxylic acid arylamide analogues NEUROGEN CORPORATION (US) 2006-05-11 — — 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-20060100245-A1 Substituted biphenyl-4-carboxylic acid arylamide analogues HCAR2, AHR, HCAR3 MAPT 3567/4885MCHR1 420/4885TP53 3452/4885

“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.

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