SCHEMBL13488647

SCHEMBL13488647

CC1CCN(c2ccc(C3(c4ccc(O)cc4)C=Cc4c(cc(-c5ccc(-c6ccc(OC(=O)c7ccc(O)cc7)cc6)cc5)c5ccccc45)O3)cc2)CC1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 3/20 0.34
MAPT P10636 8/20 0.31
KMT2A Q03164 5/20 0.31
MEN1 O00255 3/20 0.31
LMNA P02545 2/20 0.31
HIF1A Q16665 3/20 0.31
TP53 P04637 1/20 0.31
ALDH1A1 P00352 3/20 0.30
NPSR1 Q6W5P4 2/20 0.30
GAA P10253 2/20 0.30
HSD17B10 Q99714 2/20 0.30
KDM4E B2RXH2 2/20 0.30
CCNC P24863 1/20 0.30
CDK8 P49336 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
ALOX15 P16050 1/20 0.30
HTT P42858 1/20 0.30
FFAR4 Q5NUL3 1/20 0.30
MGLL Q99685 1/20 0.30
NPC1 O15118 1/20 0.30

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
SCHEMBL13488648 0.92 NPSR1 (0.33) USP2MAPTKMT2ATP53ALDH1A1
SCHEMBL13239925 0.90 NPY1R (0.35) USP2MAPTKMT2AMEN1LMNA
SCHEMBL3213924 0.89 HRH3 (0.38) MAPTLMNASMN1; SMN2NPC1HPGD
SCHEMBL3039044 0.84 HRH3 (0.37) MAPTHPGD
SCHEMBL3207189 0.80 HRH3 (0.38) MAPTKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL13240239 0.79 KIF11 (0.36) MAPTKMT2AMEN1ALDH1A1GAA
SCHEMBL3210078 0.75 HRH3 (0.36) MAPTALDH1A1KDM4EHPGD
SCHEMBL13488494 0.74 DHODH (0.32) USP2KMT2AMEN1ALDH1A1HSD17B10
SCHEMBL13488493 0.74 DHODH (0.32) USP2KMT2AMEN1ALDH1A1HSD17B10
SCHEMBL3039685 0.73 ACHE (0.40) MAPTKMT2AMEN1HIF1ATP53

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-20100039688-A1 6-(BIPHENYL-ESTER)-3H-NAPHTHO[2,1-B]PYRANS AS PHOTOCHROMIC DICHROIC DYES AND OPTICAL ARTICLE CONTAINING THEM ESSILOR INTERNATIONAL (FR) 2010-02-18 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-20100039688-A1 6-(BIPHENYL-ESTER)-3H-NAPHTHO[2,1-B]PYRANS AS PHOTOCHROMIC DICHROIC DYES AND OPTICAL ARTICLE CONTAINING THEM NR0B1, CBR1, NR0B2 USP2 4079/4885MAPT 4476/4885KMT2A 2816/4885

“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.