SCHEMBL5923652

SCHEMBL5923652

CCCCc1ccc(CNC(=N)Nc2nc(C)cc(OC)n2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 2/20 0.48
▸ LMNA P02545 4/20 0.44
▸ GAA P10253 3/20 0.44
▸ TSHR P16473 3/20 0.44
▸ MAPT P10636 3/20 0.44
▸ ALDH1A1 P00352 3/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ POLB P06746 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ GLA P06280 1/20 0.44
▸ HPGD P15428 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ MAPK1 P28482 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ ADORA2A P29274 1/20 0.39
▸ SMN1; SMN2 Q16637 3/20 0.39
▸ USP2 O75604 1/20 0.38
▸ CYP1A2 P05177 2/20 0.36
▸ CYP2C9 P11712 2/20 0.36
▸ CYP2C19 P33261 2/20 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
SCHEMBL5923309 0.93 LMNA (0.46) HTTLMNAGAATSHRMAPT
SCHEMBL5923073 0.90 RAB9A (0.48) HTTLMNAGAATSHRMAPT
SCHEMBL5923316 0.84 MAPK1 (0.45) HTTLMNAGAATSHRMAPT
SCHEMBL5923663 0.83 HTT (0.58) HTTLMNAGAATSHRMAPT
SCHEMBL5923317 0.83 MEN1 (0.41) HTTLMNAGAATSHRMAPT
SCHEMBL5923398 0.79 RAB9A (0.40) HTTLMNAGAAMAPTALDH1A1
SCHEMBL5923669 0.77 MAPK1 (0.43) HTTLMNAGAAMAPTALDH1A1
SCHEMBL5923041 0.77 SPHK1 (0.44) HTTLMNAGAAMAPTALDH1A1
SCHEMBL5923164 0.76 TUBB4A (0.39) LMNATSHRMAPTMEN1KMT2A
SCHEMBL5923352 0.75 HTT (0.47) HTTLMNAMAPTALDH1A1KMT2A

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 HTT 1227/4885LMNA 620/4885GAA 83/4885

“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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