SCHEMBL2956150

SCHEMBL2956150

c1cc2ccc3ccc(-c4ccc(-c5ccc6ccc7cccc8ccc5c6c78)c5ccccc45)c4ccc(c1)c2c34

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.64
HSD17B10 Q99714 9/20 0.64
HPGD P15428 8/20 0.64
CYP1A2 P05177 4/20 0.64
THRB P10828 1/20 0.64
ERBB2 P04626 1/20 0.61
FYN P06241 1/20 0.61
MAOA P21397 1/20 0.61
ACHE P22303 1/20 0.61
AHR P35869 1/20 0.61
TSHR P16473 7/20 0.55
CYP3A4 P08684 3/20 0.55
CYP1A1 P04798 1/20 0.55
CYP1B1 Q16678 1/20 0.55
L3MBTL1 Q9Y468 4/20 0.54
TDP1 Q9NUW8 2/20 0.54
HPRT1 P00492 1/20 0.48
MAPK1 P28482 4/20 0.46
ATM Q13315 2/20 0.46
CYP2A6 P11509 1/20 0.46

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
SCHEMBL29814212 0.95 ALDH1A1 (0.61) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL2124728 0.95 ALDH1A1 (0.61) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL29413360 0.95 ALDH1A1 (0.61) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL441488 0.93 HSD17B10 (0.56) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL5334139 0.93 ALDH1A1 (0.56) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL444017 0.91 ALDH1A1 (0.60) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL30744773 0.91 HSD17B10 (0.58) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL3786972 0.91 HSD17B10 (0.58) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL3792057 0.91 HSD17B10 (0.58) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL27694292 0.89 ALDH1A1 (0.64) ALDH1A1HSD17B10HPGDCYP1A2THRB

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-20100025661-A1 Luminescent material and organic electroluminescent device using the same JNC CORPORATION (JP) 2010-02-04 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-20100025661-A1 Luminescent material and organic electroluminescent device using the same TRPV3, TRPC3, HVCN1 ALDH1A1 944/4885HSD17B10 1895/4885HPGD 3560/4885

“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.