SCHEMBL2808385

SCHEMBL2808385

O=C(Cc1nccs1)Nc1ccc2[nH]c(-c3ccc(C(=O)c4ccccc4C(F)(F)F)cc3)nc2c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCD O00767 4/20 0.67
MAPT P10636 6/20 0.46
SMN1; SMN2 Q16637 5/20 0.46
KMT2A Q03164 5/20 0.46
RAB9A P51151 4/20 0.46
ALDH1A1 P00352 3/20 0.46
NPC1 O15118 3/20 0.46
MEN1 O00255 2/20 0.46
KDM4E B2RXH2 4/20 0.42
PKM P14618 1/20 0.42
HPGD P15428 3/20 0.42
POLB P06746 2/20 0.42
HTT P42858 1/20 0.42
APAF1 O14727 1/20 0.41
PPARG P37231 1/20 0.41
RECQL P46063 1/20 0.41
SMAD3 P84022 1/20 0.41
PTK2B Q14289 1/20 0.41
ESR2 Q92731 1/20 0.41
NR2E3 Q9Y5X4 1/20 0.41

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
SCHEMBL2806384 0.82 MAPT (0.62) SCDMAPTSMN1; SMN2KMT2ARAB9A
SCHEMBL2317971 0.82 SCD (0.72) SCD
SCHEMBL2805768 0.79 SCD (0.72) SCDMAPTSMN1; SMN2KMT2ARAB9A
SCHEMBL2804167 0.77 SCD (0.73) SCDMAPTSMN1; SMN2KMT2ARAB9A
SCHEMBL2808387 0.76 SCD (0.56) SCD
SCHEMBL2319097 0.76 SCD (0.54) SCDMAPTSMN1; SMN2KMT2ARAB9A
SCHEMBL2319100 0.73 SCD (0.51) SCD
SCHEMBL2802895 0.73 SCD (0.56) SCDMAPTSMN1; SMN2KMT2ARAB9A
SCHEMBL8768635 0.70 MMP2 (0.65) MAPTSMN1; SMN2KMT2ARAB9AALDH1A1
SCHEMBL2803272 0.69 SCD (0.71) SCDMAPTSMN1; SMN2KMT2ARAB9A

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-20100240580-A1 AZOLOARINE DERIVATIVES, METHOD FOR THE PRODUCTION THEREOF, PHARMACEUTICALS CONTAINING THESE COMPOUNDS AND THE USE THEREOF SANOFI-AVENTIS (FR) 2010-09-23 US claimed
US-20100240580-A1 AZOLOARINE DERIVATIVES, METHOD FOR THE PRODUCTION THEREOF, PHARMACEUTICALS CONTAINING THESE COMPOUNDS AND THE USE THEREOF SANOFI-AVENTIS (FR) 2010-09-23 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-20100240580-A1 AZOLOARINE DERIVATIVES, METHOD FOR THE PRODUCTION THEREOF, PHARMACEUTICALS CONTAINING THESE COMPOUNDS AND THE USE THEREOF CYP3A43, CYP11B1, CYP11B2 SCD 3183/4885MAPT 3100/4885SMN1; SMN2 4476/4885

“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.