SCHEMBL5922913

SCHEMBL5922913

Cc1cccc(NC(=N)Nc2nc(C)cc(C)n2)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 3/20 0.54
▸ CYP2D6 P10635 2/20 0.54
▸ POLB P06746 1/20 0.54
▸ CRHBP P24387 1/20 0.54
▸ CRHR2 Q13324 1/20 0.54
▸ CYP3A4 P08684 1/20 0.51
▸ CYP2C19 P33261 1/20 0.51
▸ RAB9A P51151 3/20 0.50
▸ SMN1; SMN2 Q16637 3/20 0.50
▸ NPC1 O15118 2/20 0.50
▸ GBA1 P04062 1/20 0.50
▸ MAPK1 P28482 1/20 0.50
▸ ATM Q13315 1/20 0.48
▸ HSD17B10 Q99714 1/20 0.47
▸ USP2 O75604 1/20 0.45
▸ KMT2A Q03164 3/20 0.44
▸ PKM P14618 1/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ RXFP1 Q9HBX9 1/20 0.44
▸ RECQL P46063 1/20 0.43

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
SCHEMBL13856217 0.85 NR4A1 (0.57) CYP1A2CYP2D6POLBCRHBPCRHR2
SCHEMBL6422898 0.85 HSD17B10 (0.62) CYP1A2CYP2D6CYP3A4CYP2C19RAB9A
SCHEMBL5923163 0.84 RAB9A (0.52) POLBCRHBPCRHR2RAB9ASMN1; SMN2
SCHEMBL14861785 0.82 GAA (0.46) POLBRAB9ASMN1; SMN2NPC1MAPK1
SCHEMBL5923530 0.82 RAB9A (0.44) CYP1A2CYP2D6POLBCRHBPCRHR2
SCHEMBL5923368 0.82 CRHBP (0.50) CRHBPCRHR2RAB9ASMN1; SMN2NPC1
SCHEMBL5923599 0.80 ALDH1A1 (0.49) POLBRAB9ASMN1; SMN2NPC1MAPK1
SCHEMBL5923055 0.80 RAB9A (0.49) CYP1A2POLBCYP2C19RAB9ASMN1; SMN2
SCHEMBL5923308 0.80 RAB9A (0.48) CYP1A2POLBCYP2C19RAB9ASMN1; SMN2
SCHEMBL13302660 0.80 NPSR1 (0.57) CYP1A2CYP2D6POLBCYP3A4CYP2C19

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-20160374997-A1 ANTIBIOTIC COMPOUNDS THAT INHIBIT BACTERIAL PROTEIN SYNTHESIS BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM 2016-12-29 — — US disclosed
US-20160220510-A1 ANTIBIOTIC COMPOUNDS THAT INHIBIT BACTERIAL PROTEIN SYNTHESIS BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM 2016-08-04 — — US disclosed
US-20060100225-A1 Heteroaryl guanidines; inhibitors of viral replication ACHILLION PHARMACEUTICALS, INC. 2006-05-11 — — 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 (3 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-20160374997-A1 ANTIBIOTIC COMPOUNDS THAT INHIBIT BACTERIAL PROTEIN SYNTHESIS AARS1, EPRS1, EEF1G CYP1A2 3382/4885CYP2D6 2559/4885POLB 1612/4885
US-20160220510-A1 ANTIBIOTIC COMPOUNDS THAT INHIBIT BACTERIAL PROTEIN SYNTHESIS AARS1, EPRS1, EEF1G CYP1A2 3382/4885CYP2D6 2559/4885POLB 1612/4885
US-20060100225-A1 Heteroaryl guanidines; inhibitors of viral replication PIGS, GUCY1A1, GUCY1B1 CYP1A2 295/4885CYP2D6 562/4885POLB 2292/4885

“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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