SCHEMBL10311786

SCHEMBL10311786

COc1ccc(NC(=S)c2ccc(N=O)cc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 10/20 0.68
▸ RAB9A P51151 9/20 0.68
▸ SMN1; SMN2 Q16637 7/20 0.68
▸ HPGD P15428 2/20 0.68
▸ ALDH1A1 P00352 2/20 0.68
▸ MAPT P10636 3/20 0.65
▸ CYP1A2 P05177 3/20 0.65
▸ CYP2C19 P33261 2/20 0.65
▸ CYP3A4 P08684 1/20 0.65
▸ CYP2C9 P11712 1/20 0.65
▸ GAA P10253 2/20 0.62
▸ LMNA P02545 1/20 0.61
▸ TDP1 Q9NUW8 1/20 0.61
▸ TP53 P04637 1/20 0.53
▸ ALOX15 P16050 1/20 0.53
▸ KDM4E B2RXH2 2/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ KMT2A Q03164 1/20 0.49
▸ MAOA P21397 2/20 0.46
▸ MAOB P27338 2/20 0.46

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
SCHEMBL10624822 0.87 NPC1 (0.86) NPC1RAB9ASMN1; SMN2HPGDALDH1A1
SCHEMBL10311785 0.83 RAB9A (0.78) NPC1RAB9ASMN1; SMN2ALDH1A1MAPT
SCHEMBL12509568 0.83 RAB9A (0.55) NPC1RAB9ASMN1; SMN2ALDH1A1MAPT
SCHEMBL9224928 0.80 MAPT (0.68) NPC1RAB9ASMN1; SMN2HPGDALDH1A1
SCHEMBL5426217 0.80 RAB9A (0.73) NPC1RAB9ASMN1; SMN2HPGDALDH1A1
SCHEMBL28471116 0.79 NPC1 (1.00) NPC1RAB9ASMN1; SMN2HPGDALDH1A1
SCHEMBL1180922 0.79 NPC1 (1.00) NPC1RAB9ASMN1; SMN2HPGDALDH1A1
SCHEMBL10625136 0.77 SMN1; SMN2 (1.00) NPC1RAB9ASMN1; SMN2HPGDALDH1A1
SCHEMBL2633338 0.77 MEN1 (0.66) NPC1RAB9ASMN1; SMN2HPGDALDH1A1
SCHEMBL2061371 0.77 MEN1 (0.66) NPC1RAB9ASMN1; SMN2HPGDALDH1A1

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-20120177572-A1 AMYLOID IMAGING AS A SURROGATE MARKER FOR EFFICACY OF ANTI-AMYLOID THERAPIES UNIVERSITY OF PITTSBURGH- OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION 2012-07-12 — — US disclosed
US-20080286202-A1 Method of Diagnosing Prodromal Forms of Diseases Associated With Amyloid Deposition UNIVERSITY OF PITTSBURGH (US) 2008-11-20 — — 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 (2 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-20120177572-A1 AMYLOID IMAGING AS A SURROGATE MARKER FOR EFFICACY OF ANTI-AMYLOID THERAPIES TTR, APP, SAAL1 NPC1 332/4885RAB9A 3270/4885SMN1; SMN2 117/4885
US-20080286202-A1 Method of Diagnosing Prodromal Forms of Diseases Associated With Amyloid Deposition PSEN2, PSEN1, APP NPC1 109/4885RAB9A 3106/4885SMN1; SMN2 650/4885

“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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