SCHEMBL2986643

SCHEMBL2986643

COC(=O)c1sc2c(-c3ccccc3)c(-c3ccc(Cl)cc3)[nH]c2c1C=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.41
ALDH1A1 P00352 1/20 0.41
NPSR1 Q6W5P4 3/20 0.41
KMT2A Q03164 1/20 0.41
MAPT P10636 4/20 0.40
TP53 P04637 3/20 0.40
LMNA P02545 1/20 0.39
KDM4E B2RXH2 2/20 0.39
NPC1 O15118 1/20 0.39
CASP3 P42574 1/20 0.39
SENP8 Q96LD8 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
SENP6 Q9GZR1 1/20 0.39
MDM2 Q00987 2/20 0.38
TRPM8 Q7Z2W7 1/20 0.38
SLC6A4 P31645 1/20 0.38
SLC6A3 Q01959 1/20 0.38
AR P10275 2/20 0.37
PTGES O14684 1/20 0.37
ALOX5 P09917 1/20 0.37

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
SCHEMBL2986641 0.79 SLC6A3 (0.38) RAB9ANPSR1KMT2AMAPTKDM4E
SCHEMBL2982702 0.75 KDM4E (0.39) RAB9AALDH1A1NPSR1KMT2AMAPT
SCHEMBL2986582 0.74 PTGS2 (0.42) RAB9AALDH1A1NPSR1MAPTTP53
SCHEMBL2997444 0.67 MAP2 (0.44) MAPTKDM4EPTGS2KDR
SCHEMBL2987902 0.66 LMNA (0.45) RAB9AALDH1A1KMT2AMAPTLMNA
SCHEMBL28574062 0.66 ERCC1 (0.59) RAB9AALDH1A1KMT2AMAPTLMNA
SCHEMBL68469 0.65 PLA2G1B (0.60) RAB9AALDH1A1NPSR1KMT2AMAPT
SCHEMBL4998521 0.65 SLC6A3 (0.48) RAB9AALDH1A1MAPTLMNANPC1
SCHEMBL10287442 0.64 MAPT (0.56) RAB9AALDH1A1NPSR1KMT2AMAPT
SCHEMBL11404030 0.64 TRPM8 (0.49) RAB9AALDH1A1KMT2AMAPTLMNA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7781431-B2 Thienopyrroles as antiviral agents ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P ANGELETTI SPA (IT) 2010-08-24 US disclosed
US-20090036443-A1 Thienopyrroles as antiviral agents ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI (IT) 2009-02-05 US disclosed
EP-1664059-B1 THIENOPYRROLES AS ANTIVIRAL AGENTS ANGELETTI P IST RICHERCHE BIO (IT) 2007-09-12 EP 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-20090036443-A1 Thienopyrroles as antiviral agents ZC3HAV1, XDH, TPMT RAB9A 1953/4885ALDH1A1 397/4885NPSR1 1226/4885

“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.