SCHEMBL5923080

SCHEMBL5923080

Cc1ccnc(NC(=N)Nc2cccc(Cc3ccccc3)c2)n1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 4/20 0.48
▸ NPC1 O15118 3/20 0.48
▸ SMN1; SMN2 Q16637 2/20 0.48
▸ POLB P06746 1/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ LMNA P02545 1/20 0.43
▸ PARP1 P09874 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.40
▸ SYK P43405 2/20 0.40
▸ ALDH1A1 P00352 2/20 0.39
▸ SIRT2 Q8IXJ6 1/20 0.39
▸ PRSS1 P07477 1/20 0.39
▸ PRSS2 P07478 1/20 0.39
▸ PRSS3 P35030 1/20 0.39
▸ MAPK1 P28482 1/20 0.38
▸ TP53 P04637 1/20 0.37
▸ PKM P14618 1/20 0.37
▸ MAPT P10636 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ CFD P00746 1/20 0.36

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
SCHEMBL5923230 0.88 SMN1; SMN2 (0.50) RAB9ANPC1SMN1; SMN2POLBKMT2A
SCHEMBL5923599 0.88 ALDH1A1 (0.49) RAB9ANPC1SMN1; SMN2POLBKMT2A
SCHEMBL2803590 0.85 RAB9A (0.49) RAB9ANPC1SMN1; SMN2POLBKMT2A
SCHEMBL5923526 0.84 MAPK1 (0.57) RAB9ANPC1SMN1; SMN2POLBKMT2A
SCHEMBL5923351 0.81 RAB9A (0.50) RAB9ANPC1SMN1; SMN2KMT2ALMNA
SCHEMBL5923480 0.81 RAB9A (0.58) RAB9ANPC1SMN1; SMN2POLBKMT2A
SCHEMBL5923031 0.81 HTT (0.54) RAB9ASMN1; SMN2POLBKMT2ALMNA
SCHEMBL5923619 0.80 KMT2A (0.54) RAB9ANPC1SMN1; SMN2POLBKMT2A
SCHEMBL5923263 0.78 SAE1 (0.56) RAB9ANPC1SMN1; SMN2POLBKMT2A
SCHEMBL5923353 0.78 SMN1; SMN2 (0.48) RAB9ANPC1SMN1; SMN2KMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060100225-A1 Heteroaryl guanidines; inhibitors of viral replication ACHILLION PHARMACEUTICALS, INC. 2006-05-11 — — US claimed
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 (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-20060100225-A1 Heteroaryl guanidines; inhibitors of viral replication PIGS, GUCY1A1, GUCY1B1 RAB9A 410/4885NPC1 82/4885SMN1; SMN2 1226/4885

“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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