SCHEMBL14096436

SCHEMBL14096436

Cc1c(NC(=S)NC(=O)c2cc3ccccc3o2)cccc1-c1nc2cc(Cl)ccc2o1

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 2/20 0.62
▸ RAB9A P51151 1/20 0.62
▸ MAPT P10636 8/20 0.59
▸ TP53 P04637 5/20 0.59
▸ ALDH1A1 P00352 4/20 0.59
▸ SMN1; SMN2 Q16637 3/20 0.59
▸ HPGD P15428 1/20 0.59
▸ KMT2A Q03164 2/20 0.58
▸ THRB P10828 3/20 0.57
▸ RXFP1 Q9HBX9 2/20 0.57
▸ POLB P06746 2/20 0.53
▸ DUSP1 P28562 1/20 0.51
▸ LMNA P02545 1/20 0.50
▸ L3MBTL1 Q9Y468 1/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ HTT P42858 1/20 0.49
▸ NPSR1 Q6W5P4 1/20 0.49

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
SCHEMBL14096560 0.83 MAPT (0.83) NPC1RAB9AMAPTTP53ALDH1A1
SCHEMBL31451702 0.75 MAPT (0.69) NPC1RAB9AMAPTTP53ALDH1A1
SCHEMBL4361940 0.75 SMN1; SMN2 (1.00) NPC1RAB9AMAPTTP53ALDH1A1
SCHEMBL14096547 0.75 ALDH1A1 (0.79) NPC1RAB9AMAPTTP53ALDH1A1
SCHEMBL31451268 0.74 MAPT (0.67) NPC1RAB9AMAPTTP53ALDH1A1
SCHEMBL31451507 0.74 MAPT (0.64) NPC1RAB9AMAPTTP53ALDH1A1
SCHEMBL14096588 0.73 ALDH1A1 (0.61) NPC1RAB9AMAPTTP53ALDH1A1
SCHEMBL31451443 0.73 TP53 (0.66) NPC1RAB9AMAPTTP53ALDH1A1
SCHEMBL31451710 0.73 MAPT (0.66) MAPTTP53ALDH1A1SMN1; SMN2HPGD
SCHEMBL31451706 0.73 MAPT (0.71) NPC1RAB9AMAPTTP53ALDH1A1

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-20080207760-A1 Pharmaceutical Compositions For and Methods of Inhibiting Hcv ACHILLION PHARMACEUTICALS, INC. (US) 2008-08-28 — — US disclosed
US-20080207760-A1 Pharmaceutical Compositions For and Methods of Inhibiting Hcv ACHILLION PHARMACEUTICALS, INC. (US) 2008-08-28 — — 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-20080207760-A1 Pharmaceutical Compositions For and Methods of Inhibiting Hcv RNASE1, SARS1, EIF2AK2 NPC1 886/4885RAB9A 3144/4885MAPT 4038/4885

“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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