SCHEMBL1392122

SCHEMBL1392122

CCOc1nc(Nc2ccc3nc(C)sc3c2)nc(Nc2ccc3nc(C)sc3c2)n1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 5/20 0.54
▸ KMT2A Q03164 5/20 0.54
▸ KDM4E B2RXH2 3/20 0.54
▸ POLB P06746 2/20 0.50
▸ RAB9A P51151 2/20 0.50
▸ NPC1 O15118 1/20 0.50
▸ RXFP1 Q9HBX9 1/20 0.50
▸ MAPT P10636 7/20 0.49
▸ LMNA P02545 4/20 0.49
▸ PDE4B Q07343 1/20 0.49
▸ PDE4D Q08499 1/20 0.49
▸ LDHA P00338 2/20 0.48
▸ ALDH1A1 P00352 4/20 0.47
▸ SMN1; SMN2 Q16637 2/20 0.47
▸ TSHR P16473 1/20 0.47
▸ HPGD P15428 2/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46
▸ CA1 P00915 1/20 0.45
▸ CA2 P00918 1/20 0.45

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
SCHEMBL1391263 0.92 POLB (0.51) MEN1KMT2AKDM4EPOLBRAB9A
SCHEMBL1390767 0.86 MAPT (0.63) MEN1KMT2ARAB9ANPC1RXFP1
SCHEMBL1391837 0.85 MEN1 (0.46) MEN1KMT2AKDM4EPOLBRAB9A
SCHEMBL1392328 0.83 CYP3A4 (0.43) MEN1KMT2AKDM4ERAB9ANPC1
SCHEMBL1392337 0.83 NPC1 (0.40) MEN1KMT2AKDM4EPOLBRAB9A
SCHEMBL1391338 0.80 KDM4E (0.61) MEN1KMT2AKDM4ERAB9ANPC1
SCHEMBL1392162 0.77 MAPT (0.63) MEN1KMT2AKDM4EMAPTLMNA
SCHEMBL1391803 0.77 KDM4E (0.61) MEN1KMT2AKDM4ERAB9ANPC1
SCHEMBL8261943 0.73 KMT2A (0.69) MEN1KMT2AKDM4EPOLBRAB9A
SCHEMBL1392166 0.72 TSHR (0.64) MEN1KMT2AKDM4ERAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120009151-A1 Triazines And Related Compounds Having Antiviral Activity, Compositions And Methods Thereof PROGENICS PHARMACEUTICALS, INC. (US) 2012-01-12 — — US disclosed
EP-2231624-A2 TRIAZINES AND RELATED COMPOUNDS HAVING ANTIVIRAL ACTIVITY, COMPOSITIONS AND METHODS THEREOF Progenics Pharmaceuticals, Inc. (US) 2010-09-29 — — EP disclosed
WO-2009091388-A2 TRIAZINES AND RELATED COMPOUNDS HAVING ANTIVIRAL ACTIVITY, COMPOSITIONS AND METHODS THEREOF PROGENICS PHARMACEUTICALS, INC. (US) 2009-07-23 — — 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 (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-20120009151-A1 Triazines And Related Compounds Having Antiviral Activity, Compositions And Methods Thereof HAVCR2, ZC3HAV1, MAVS MEN1 4840/4885KMT2A 4066/4885KDM4E 3281/4885

“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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