SCHEMBL17107237

SCHEMBL17107237

C=CCn1c(-c2ccccc2)cs/c1=N\C(=O)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.53
HSD17B10 Q99714 4/20 0.53
ALDH1A1 P00352 8/20 0.47
SMN1; SMN2 Q16637 6/20 0.47
NPC1 O15118 4/20 0.47
TP53 P04637 1/20 0.47
POLB P06746 1/20 0.46
TSHR P16473 1/20 0.46
MAPT P10636 5/20 0.45
HTT P42858 4/20 0.45
KDM4E B2RXH2 4/20 0.44
HPGD P15428 2/20 0.44
KMT2A Q03164 1/20 0.44
ALOX5 P09917 1/20 0.44
PTGS2 P35354 1/20 0.44
LMNA P02545 4/20 0.43
MAPK1 P28482 3/20 0.40
GAA P10253 2/20 0.40
PKM P14618 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.39

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
SCHEMBL17131996 1.00 RAB9A (0.53) RAB9AHSD17B10ALDH1A1SMN1; SMN2NPC1
SCHEMBL17107239 1.00 RAB9A (0.53) RAB9AHSD17B10ALDH1A1SMN1; SMN2NPC1
SCHEMBL17107128 0.83 RAB9A (0.71) RAB9AHSD17B10ALDH1A1SMN1; SMN2NPC1
SCHEMBL17132003 0.83 RAB9A (0.71) RAB9AHSD17B10ALDH1A1SMN1; SMN2NPC1
SCHEMBL17107129 0.83 RAB9A (0.71) RAB9AHSD17B10ALDH1A1SMN1; SMN2NPC1
SCHEMBL17107151 0.81 RAB9A (0.50) RAB9AHSD17B10ALDH1A1SMN1; SMN2NPC1
SCHEMBL17131988 0.81 RAB9A (0.50) RAB9AHSD17B10ALDH1A1SMN1; SMN2NPC1
SCHEMBL17107150 0.81 RAB9A (0.50) RAB9AHSD17B10ALDH1A1SMN1; SMN2NPC1
SCHEMBL17107112 0.81 RAB9A (0.61) RAB9AHSD17B10ALDH1A1SMN1; SMN2NPC1
SCHEMBL17107111 0.81 RAB9A (0.61) RAB9AHSD17B10ALDH1A1SMN1; SMN2NPC1

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-20150274714-A1 ANTI-MIGRATION AND ANTI-INVASION THIAZOLE ANALOGS FOR TREATMENT OF CELLULAR PROLIFERATIVE DISEASE XAVIER UNIVERSITY OF LOUISIANA 2015-10-01 US claimed
US-9650369-B2 Anti-migration and anti-invasion thiazole analogs for treatment of cellular proliferative disease XAVIER UNIVERSITY OF LOUISIANA (US) 2017-05-16 US disclosed
US-20150274714-A1 ANTI-MIGRATION AND ANTI-INVASION THIAZOLE ANALOGS FOR TREATMENT OF CELLULAR PROLIFERATIVE DISEASE XAVIER UNIVERSITY OF LOUISIANA 2015-10-01 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-20150274714-A1 ANTI-MIGRATION AND ANTI-INVASION THIAZOLE ANALOGS FOR TREATMENT OF CELLULAR PROLIFERATIVE DISEASE MKI67, MIF, NUDC RAB9A 1305/4885HSD17B10 1947/4885ALDH1A1 1082/4885

“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.