SCHEMBL5923192

SCHEMBL5923192

COc1cc(C)nc(NC(=N)Nc2ccc(Oc3ccc(Cl)cc3)cc2)n1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 3/20 0.47
▸ SMN1; SMN2 Q16637 3/20 0.43
▸ KCNH2 Q12809 1/20 0.40
▸ SLC2A1 P11166 2/20 0.40
▸ MAPT P10636 3/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ HTT P42858 2/20 0.39
▸ POLB P06746 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ RECQL P46063 1/20 0.39
▸ LMNA P02545 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ ANXA2 P07355 1/20 0.38
▸ S100A10 P60903 1/20 0.38
▸ PDGFRA P16234 1/20 0.38
▸ KDR P35968 1/20 0.38

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
SCHEMBL5923518 0.93 SMN1; SMN2 (0.49) SMN1; SMN2KCNH2MAPTALDH1A1MEN1
SCHEMBL5923286 0.90 ALDH1A1 (0.47) SMN1; SMN2KCNH2MAPTALDH1A1MEN1
SCHEMBL5923234 0.89 SMN1; SMN2 (0.48) TSHRSMN1; SMN2MAPTALDH1A1MEN1
SCHEMBL4099597 0.82 LMNA (0.49) POLBKDM4ELMNA
SCHEMBL5923231 0.82 SMN1; SMN2 (0.50) SMN1; SMN2MAPTALDH1A1MEN1KMT2A
SCHEMBL5923153 0.81 HTT (0.46) TSHRSMN1; SMN2MAPTALDH1A1MEN1
SCHEMBL5923278 0.80 ALDH1A1 (0.49) TSHRSMN1; SMN2KCNH2MAPTALDH1A1
SCHEMBL5923283 0.80 MAPT (0.58) TSHRSMN1; SMN2SLC2A1MAPTALDH1A1
SCHEMBL5923337 0.80 SCN9A (0.51) KCNH2MEN1KMT2AHTTPOLB
SCHEMBL5923240 0.80 SMN1; SMN2 (0.50) TSHRSMN1; SMN2MAPTALDH1A1MEN1

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 TSHR 1803/4885SMN1; SMN2 1226/4885KCNH2 1241/4885

“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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