SCHEMBL12578240

SCHEMBL12578240

Cc1cccc2nc3c4ccccc4c4ccccc4c3nc12

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 4/20 0.49
▸ NPC1 O15118 2/20 0.49
▸ KMT2A Q03164 2/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ HCRTR1 O43613 1/20 0.49
▸ MAPT P10636 4/20 0.47
▸ MAPK1 P28482 1/20 0.47
▸ GPR3 P46089 1/20 0.45
▸ CYP2A6 P11509 2/20 0.45
▸ ALDH1A1 P00352 2/20 0.45
▸ KDM1A O60341 1/20 0.43
▸ CYP1A2 P05177 4/20 0.42
▸ NQO2 P16083 3/20 0.42
▸ PARP1 P09874 1/20 0.41
▸ ELANE P08246 1/20 0.41
▸ BACE1 P56817 1/20 0.40
▸ TP53 P04637 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ LMNA P02545 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
SCHEMBL31643056 0.85 RAB9A (0.53) RAB9ANPC1KMT2AMEN1HCRTR1
SCHEMBL20475325 0.85 RAB9A (0.53) RAB9ANPC1KMT2AMEN1HCRTR1
SCHEMBL183009 0.83 NQO2 (0.57) RAB9ANPC1KMT2AMEN1HCRTR1
Bromide SCHEMBL11421481 0.81 NQO2 (0.55) RAB9ANPC1KMT2AMEN1HCRTR1
SCHEMBL8048534 0.81 CYP2A6 (0.52) RAB9ANPC1KMT2AMEN1HCRTR1
SCHEMBL14015461 0.81 CYP1A2 (0.50) KMT2AMEN1MAPTGPR3CYP2A6
SCHEMBL1994979 0.78 MAPT (0.50) RAB9ANPC1KMT2AMEN1HCRTR1
SCHEMBL18805402 0.78 MYC (0.52) RAB9ANPC1KMT2AMEN1HCRTR1
SCHEMBL29581869 0.78 MAPT (0.56) RAB9ANPC1KMT2AHCRTR1MAPT
SCHEMBL732274 0.78 MAPT (0.56) RAB9ANPC1KMT2AHCRTR1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8529796-B2 Charge transport compositions and electronic devices made with such compositions E I DU PONT DE NEMOURS AND COMPANY (US) 2013-09-10 — — US disclosed
US-20130009142-A1 CHARGE TRANSPORT COMPOSITIONS AND ELECTRONIC DEVICES MADE WITH SUCH COMPOSITIONS E I DU PONT DE NEMOURS AND COMPANY (US) 2013-01-10 — — US disclosed
US-8293139-B2 Charge transport compositions and electronic devices made with such compositions E I DU PONT DE NEMOURS AND COMPANY (US) 2012-10-23 — — US disclosed
US-8287769-B2 Charge transport compositions and electronic devices made with such compositions E I DU PONT DE NEMOURS AND COMPANY (US) 2012-10-16 — — US disclosed
US-20110140092-A1 CHARGE TRANSPORT COMPOSITIONS AND ELECTRONIC DEVICES MADE WITH SUCH COMPOSITIONS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2011-06-16 — — US disclosed
US-20110133173-A1 CHARGE TRANSPORT COMPOSITIONS AND ELECTRONIC DEVICES MADE WITH SUCH COMPOSITIONS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2011-06-09 — — US disclosed
US-7914706-B2 Quinoxaline derivative; light-emitting diode, light-emitting electrochemical cell, photodetector, anti-quenching materials E. I. DU PONT DE NEMOURS AND COMPANY (US) 2011-03-29 — — US disclosed
US-20090242837-A1 CHARGE TRANSPORT COMPOSITIONS AND ELECTRONIC DEVICES MADE WITH SUCH COMPOSITIONS E.I. DU PONT DE NEMOURS AND COMPANY (US) 2009-10-01 — — US disclosed
US-20080227981-A1 CHARGE TRANSPORT COMPOSITIONS AND ELECTRONIC DEVICES MADE WITH SUCH COMPOSITIONS LG CHEM, LTD. (KR) 2008-09-18 — — US disclosed
US-7265378-B2 Electronic devices made with electron transport and/or anti-quenching layers E. I. DU PONT DE NEMOURS AND COMPANY (US) 2007-09-04 — — US disclosed
US-7265378-B2 Electronic devices made with electron transport and/or anti-quenching layers E. I. DU PONT DE NEMOURS AND COMPANY (US) 2007-09-04 — — 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-20080227981-A1 CHARGE TRANSPORT COMPOSITIONS AND ELECTRONIC DEVICES MADE WITH SUCH COMPOSITIONS SLC26A3, SLC6A19, SLC18A3 RAB9A 1263/4885NPC1 518/4885KMT2A 2991/4885

“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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