SCHEMBL8517693

SCHEMBL8517693

NCc1cc2ccccc2c2ccccc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.56
TRPM4 Q8TD43 1/20 0.46
ALDH1A1 P00352 4/20 0.46
HSD17B10 Q99714 2/20 0.46
HIF1A Q16665 1/20 0.46
CYP1B1 Q16678 1/20 0.46
LOXL2 Q9Y4K0 2/20 0.46
HPRT1 P00492 2/20 0.44
MAPT P10636 2/20 0.42
TAAR1 Q96RJ0 2/20 0.42
POLB P06746 1/20 0.42
PKM P14618 1/20 0.42
RAD52 P43351 1/20 0.42
CYP2A6 P11509 2/20 0.42
TSHR P16473 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
KDM4E B2RXH2 2/20 0.40
MEN1 O00255 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40

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
SCHEMBL7247940 0.83 DHODH (0.49) HTR2ATRPM4ALDH1A1HSD17B10HIF1A
SCHEMBL7360085 0.79 CHEK1 (0.55) HTR2ATRPM4ALDH1A1HSD17B10HIF1A
SCHEMBL615452 0.79 TRPM4 (0.54) HTR2ATRPM4ALDH1A1HSD17B10HIF1A
SCHEMBL133410 0.78 HPRT1 (0.58) HTR2AALDH1A1HSD17B10HIF1ACYP1B1
SCHEMBL29729625 0.78 HPRT1 (0.58) HTR2AALDH1A1HSD17B10HIF1ACYP1B1
SCHEMBL27900087 0.78 HTR2A (0.52) HTR2AALDH1A1HSD17B10HIF1ACYP1B1
SCHEMBL15379970 0.78 HTR2A (0.52) HTR2AALDH1A1HSD17B10HIF1ACYP1B1
SCHEMBL8655955 0.78 HTR2A (0.52) HTR2AALDH1A1HSD17B10HIF1ACYP1B1
SCHEMBL20961847 0.78 HTR2A (0.48) HTR2AALDH1A1HSD17B10HIF1ALOXL2
SCHEMBL18138405 0.77 TRPM4 (0.46) HTR2ATRPM4ALDH1A1HSD17B10HIF1A

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9412955-B2 Fluorescent isoindoline dyes UNIVERSAL DISPLAY CORPORATION (US) 2016-08-09 US disclosed
US-20150318494-A1 Fluorescent Isoindoline Dyes UNIV SOUTHERN CALIFORNIA (US) 2015-11-05 US disclosed
US-9079885-B2 Fluorescent isoindoline dyes THE UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2015-07-14 US disclosed
US-20120153266-A1 FLUORESCENT ISOINDOLINE DYES THE UNIVERSITY OF SOUTHERN CALIFORNIA 2012-06-21 US disclosed
WO-1999065961-A1 HOLE INJECTOR POLYMERS THOMSON-CSF (FR) 1999-12-23 WO 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 (2 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-20150318494-A1 Fluorescent Isoindoline Dyes OCIAD1, OCIAD2, OXA1L HTR2A 2131/4885TRPM4 97/4885ALDH1A1 1077/4885
US-20120153266-A1 FLUORESCENT ISOINDOLINE DYES OCIAD1, OCIAD2, OXA1L HTR2A 2131/4885TRPM4 97/4885ALDH1A1 1077/4885

“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.