SCHEMBL1469563

SCHEMBL1469563

SCCNc1cccc(C(c2ccccc2)c2ccccc2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.41
ALDH1A1 P00352 1/20 0.41
CYP3A4 P08684 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
HTT P42858 1/20 0.40
HDAC3 O15379 4/20 0.38
HDAC4 P56524 4/20 0.38
HDAC1 Q13547 4/20 0.38
HDAC7 Q8WUI4 4/20 0.38
HDAC2 Q92769 4/20 0.38
HDAC10 Q969S8 4/20 0.38
HDAC11 Q96DB2 4/20 0.38
HDAC8 Q9BY41 4/20 0.38
HDAC6 Q9UBN7 4/20 0.38
HDAC9 Q9UKV0 4/20 0.38
HDAC5 Q9UQL6 4/20 0.38
ICMT O60725 1/20 0.36

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
SCHEMBL16869916 0.80 CYP3A4 (0.46) MAPTALDH1A1CYP3A4CYP1A2CYP2D6
SCHEMBL790635 0.78 ALDH1A1 (0.64) MAPTALDH1A1HDAC3HDAC4HDAC1
SCHEMBL8931478 0.72 C3AR1 (0.39) MAPTALDH1A1HDAC3HDAC4HDAC1
SCHEMBL16081661 0.72 MAPT (0.77) MAPTALDH1A1CYP3A4CYP1A2CYP2D6
SCHEMBL2418011 0.71 KDM4E (0.40) MAPTRAB9AALOX15
SCHEMBL11095520 0.69 MEN1 (0.49) MAPTALDH1A1HTTHDAC1HDAC8
SCHEMBL8351419 0.69 HDAC1 (0.37) MAPTALDH1A1HTTHDAC1HDAC8
SCHEMBL28736673 0.69 MTOR (0.36) MAPTALDH1A1CYP3A4HTTHDAC3
SCHEMBL18461175 0.69 RAPGEF4 (0.47) MAPTALDH1A1CYP3A4CYP1A2CYP2D6
SCHEMBL8351421 0.69 ALDH1A1 (0.57) MAPTALDH1A1CYP2D6HTTHDAC1

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-20110070596-A1 AGENTS AND METHODS FOR ANALYZING PROTEIN INTERACTIONS GENERAL ELECTRIC COMPANY (US) 2011-03-24 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-20110070596-A1 AGENTS AND METHODS FOR ANALYZING PROTEIN INTERACTIONS PCLAF, PCNA, DAP3 MAPT 3858/4885ALDH1A1 4011/4885CYP3A4 4782/4885

“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.