SCHEMBL5923278

SCHEMBL5923278

Cc1ccc(Oc2ccc(NC(=N)Nc3nc(C)cc(C)n3)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.49
▸ SMN1; SMN2 Q16637 3/20 0.49
▸ POLB P06746 1/20 0.49
▸ CRHBP P24387 2/20 0.43
▸ CRHR2 Q13324 2/20 0.43
▸ MAPT P10636 2/20 0.43
▸ MEN1 O00255 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ RECQL P46063 1/20 0.43
▸ RAB9A P51151 4/20 0.42
▸ GAA P10253 2/20 0.42
▸ HTT P42858 3/20 0.41
▸ KCNH2 Q12809 1/20 0.41
▸ SCN5A Q14524 1/20 0.41
▸ SCN9A Q15858 1/20 0.41
▸ PNLIP P16233 1/20 0.41
▸ MAPK14 Q16539 1/20 0.41
▸ LMNA P02545 2/20 0.40
▸ NPC1 O15118 3/20 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
SCHEMBL5923368 0.91 CRHBP (0.50) ALDH1A1SMN1; SMN2CRHBPCRHR2MAPT
SCHEMBL5923253 0.90 RAB9A (0.51) ALDH1A1SMN1; SMN2POLBCRHBPCRHR2
SCHEMBL5923286 0.89 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2POLBMAPTMEN1
SCHEMBL5923283 0.85 MAPT (0.58) ALDH1A1SMN1; SMN2POLBCRHBPCRHR2
SCHEMBL5923234 0.81 SMN1; SMN2 (0.48) ALDH1A1SMN1; SMN2POLBCRHBPCRHR2
SCHEMBL13856226 0.80 SMN1; SMN2 (0.50) ALDH1A1SMN1; SMN2CRHBPCRHR2MAPT
SCHEMBL5923192 0.80 TSHR (0.47) ALDH1A1SMN1; SMN2POLBMAPTMEN1
SCHEMBL17988142 0.80 ALDH1A1 (0.40) ALDH1A1SMN1; SMN2POLBCRHBPCRHR2
SCHEMBL5923002 0.80 MAPT (0.57) ALDH1A1SMN1; SMN2POLBCRHBPCRHR2
SCHEMBL13310313 0.80 MAPT (0.52) ALDH1A1CRHBPCRHR2MAPTMEN1

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 ALDH1A1 535/4885SMN1; SMN2 1226/4885POLB 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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