SCHEMBL606485

SCHEMBL606485

Cc1ccc2c(Br)cc3c4ccccc4c(Br)cc3c2c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.44
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
NPC1 O15118 2/20 0.39
POLB P06746 1/20 0.39
MAOA P21397 2/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C19 P33261 1/20 0.39
ALDH1A1 P00352 4/20 0.38
CYP2A6 P11509 3/20 0.38
TDP1 Q9NUW8 2/20 0.38
MAPK1 P28482 1/20 0.38
CYP1A2 P05177 4/20 0.38
CYP2C9 P11712 1/20 0.37
HPRT1 P00492 1/20 0.36
MAPT P10636 2/20 0.35
HPGD P15428 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
PRNP P04156 1/20 0.35
HTT P42858 1/20 0.35

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
SCHEMBL3911691 0.98 KIF11 (0.42) KIF11MEN1KMT2ANPC1POLB
SCHEMBL17917218 0.91 ALDH1A1 (0.39) KIF11ALDH1A1CYP2A6TDP1MAPK1
SCHEMBL23366571 0.91 HPRT1 (0.52) MEN1KMT2ANPC1MAOACYP2D6
SCHEMBL23366562 0.91 HPRT1 (0.52) MEN1KMT2ANPC1MAOACYP2D6
SCHEMBL8840916 0.86 KIF11 (0.54) KIF11MEN1KMT2ANPC1POLB
SCHEMBL17180585 0.86 KIF11 (0.54) KIF11MEN1KMT2ANPC1POLB
SCHEMBL349252 0.83 ALDH1A1 (0.43) MEN1KMT2ACYP2D6CYP2C19ALDH1A1
SCHEMBL31533202 0.83 ALDH1A1 (0.43) MEN1KMT2ACYP2D6CYP2C19ALDH1A1
SCHEMBL29558067 0.83 ALDH1A1 (0.43) MEN1KMT2ACYP2D6CYP2C19ALDH1A1
SCHEMBL24871117 0.83 MAPK1 (0.48) KIF11MEN1KMT2ANPC1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9260657-B2 Chrysene compounds for luminescent applications E I DU PONT DE NEMOURS AND COMPANY (US) 2016-02-16 US disclosed
EP-2671936-B1 Chrysene compounds for luminescent applications DU PONT (US) 2015-06-24 EP disclosed
EP-2432849-B1 CHRYSENE COMPOUNDS FOR LUMINESCENT APPLICATIONS DU PONT (US) 2015-02-25 EP disclosed
EP-2432849-B1 CHRYSENE COMPOUNDS FOR LUMINESCENT APPLICATIONS DU PONT (US) 2015-02-25 EP disclosed
EP-2674469-A1 Chrysene compounds for luminescent applications E. I. du Pont de Nemours and Company (US) 2013-12-18 EP disclosed
EP-2671936-A1 Chrysene compounds for luminescent applications E. I. du Pont de Nemours and Company (US) 2013-12-11 EP disclosed
EP-2669351-A1 Chrysene compounds for luminescent applications E. I. du Pont de Nemours and Company (US) 2013-12-04 EP disclosed
US-20120037898-A1 CHRYSENE COMPOUNDS FOR LUMINESCENT APPLICATIONS E.I. DU PONT DE NEMOURS AND COMPANY (US) 2012-02-16 US disclosed
US-20120037898-A1 CHRYSENE COMPOUNDS FOR LUMINESCENT APPLICATIONS E.I. DU PONT DE NEMOURS AND COMPANY (US) 2012-02-16 US disclosed
US-20120037898-A1 CHRYSENE COMPOUNDS FOR LUMINESCENT APPLICATIONS E.I. DU PONT DE NEMOURS AND COMPANY (US) 2012-02-16 US disclosed
US-20110215715-A1 CHRYSENE COMPOUNDS FOR BLUE OR GREEN LUMINESCENT APPLICATIONS E.I. DU PONT DE NEMOURS AND COMPANY (US) 2011-09-08 US disclosed
US-20110215715-A1 CHRYSENE COMPOUNDS FOR BLUE OR GREEN LUMINESCENT APPLICATIONS E.I. DU PONT DE NEMOURS AND COMPANY (US) 2011-09-08 US disclosed
WO-2010135403-A2 CHRYSENE COMPOUNDS FOR LUMINESCENT APPLICATIONS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2010-11-25 WO disclosed
WO-2010059837-A2 CHRYSENE COMPOUNDS FOR BLUE OR GREEN LUMINESCENT APPLICATIONS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2010-05-27 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-20110215715-A1 CHRYSENE COMPOUNDS FOR BLUE OR GREEN LUMINESCENT APPLICATIONS CRY2, CRY1, CYBA KIF11 2895/4885MEN1 408/4885KMT2A 3179/4885
US-20120037898-A1 CHRYSENE COMPOUNDS FOR LUMINESCENT APPLICATIONS CRY2, CENPE, CRY1 KIF11 3228/4885MEN1 269/4885KMT2A 2555/4885

“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.