SCHEMBL13665809

SCHEMBL13665809

N=C1C=CC(=Nc2ccc(Nc3ccccc3)cc2)C=C1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 9/20 0.48
▸ HSD17B10 Q99714 5/20 0.48
▸ CYP3A4 P08684 4/20 0.48
▸ TSHR P16473 3/20 0.48
▸ TDP1 Q9NUW8 3/20 0.48
▸ HTT P42858 2/20 0.48
▸ ALOX12 P18054 6/20 0.46
▸ L3MBTL1 Q9Y468 6/20 0.46
▸ MAPK1 P28482 4/20 0.46
▸ ALOX15 P16050 2/20 0.46
▸ PTGS1 P23219 1/20 0.46
▸ SLC6A2 P23975 1/20 0.46
▸ PTGS2 P35354 1/20 0.46
▸ HTR2B P41595 1/20 0.46
▸ MAPT P10636 8/20 0.39
▸ HPGD P15428 3/20 0.39
▸ CYP1A2 P05177 2/20 0.39
▸ CYP2C9 P11712 2/20 0.39
▸ CYP2C19 P33261 2/20 0.39
▸ S100B P04271 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
SCHEMBL13665793 1.00 ALDH1A1 (0.48) ALDH1A1HSD17B10CYP3A4TSHRTDP1
SCHEMBL13663467 0.91 ALDH1A1 (0.57) ALDH1A1HSD17B10CYP3A4TSHRTDP1
SCHEMBL13663465 0.91 ALDH1A1 (0.57) ALDH1A1HSD17B10CYP3A4TSHRTDP1
SCHEMBL13663464 0.89 ALDH1A1 (0.55) ALDH1A1HSD17B10CYP3A4TSHRTDP1
SCHEMBL13663469 0.89 ALDH1A1 (0.55) ALDH1A1HSD17B10CYP3A4TSHRTDP1
SCHEMBL13663468 0.89 ALDH1A1 (0.55) ALDH1A1HSD17B10CYP3A4TSHRTDP1
SCHEMBL13663466 0.89 ALDH1A1 (0.55) ALDH1A1HSD17B10CYP3A4TSHRTDP1
SCHEMBL13663471 0.87 ALDH1A1 (0.52) ALDH1A1HSD17B10CYP3A4TSHRTDP1
SCHEMBL29359657 0.85 ALDH1A1 (0.36) ALDH1A1HSD17B10TSHRTDP1HTT
SCHEMBL20364488 0.84 HPGD (0.42) ALDH1A1HSD17B10CYP3A4TSHRTDP1

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-8575392-B2 Charge-transporting varnish NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2013-11-05 — — US disclosed
US-20090269688-A1 CHARGE-TRANSPORTING VARNISH NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2009-10-29 — — 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-20090269688-A1 CHARGE-TRANSPORTING VARNISH SLCO2A1, SLCO2B1, SLC43A1 ALDH1A1 688/4885HSD17B10 2299/4885CYP3A4 2898/4885

“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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