SCHEMBL3592969

SCHEMBL3592969

Clc1ccc(-c2nc(C3CCNCC3)cs2)cc1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GFER P55789 1/20 0.49
RAB9A P51151 4/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
KDM4E B2RXH2 2/20 0.48
LMNA P02545 1/20 0.48
NPC1 O15118 3/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
ALDH1A1 P00352 1/20 0.47
MAPT P10636 1/20 0.47
HPGD P15428 1/20 0.47
CYP19A1 P11511 1/20 0.43
MAPKAPK2 P49137 1/20 0.42
PLAT P00750 1/20 0.42
IKBKB O14920 1/20 0.42
HTR3A P46098 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
SCHEMBL3591746 0.85 SMN1; SMN2 (0.48) RAB9ASMN1; SMN2KDM4ELMNANPC1
SCHEMBL3578450 0.85 PLAT (0.45) RAB9ASMN1; SMN2NPC1MEN1KMT2A
SCHEMBL2300164 0.85 HPGDS (0.51) RAB9ASMN1; SMN2KDM4ELMNANPC1
SCHEMBL13031632 0.85 GFER (0.51) GFERRAB9ASMN1; SMN2KDM4ELMNA
SCHEMBL3580251 0.85 MKNK1 (0.49) RAB9ASMN1; SMN2KDM4ELMNANPC1
SCHEMBL3588119 0.83 PLAT (0.51) RAB9ALMNANPC1MAPTCYP19A1
SCHEMBL3583375 0.82 GABRA1 (0.43) RAB9AKDM4ENPC1PLAT
SCHEMBL3579579 0.82 HTR2C (0.51) KDM4EMEN1KMT2APLAT
SCHEMBL3583206 0.82 MEN1 (0.52) RAB9ASMN1; SMN2KDM4ENPC1MEN1
SCHEMBL5456035 0.79 RAB9A (0.44) RAB9ASMN1; SMN2KDM4ELMNANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100286191-A1 2-Arylthiazole Derivatives as CXCR3 Receptor Modulators MERCK SHARP & DOHME CORP. 2010-11-11 US disclosed
US-20100286191-A1 2-Arylthiazole Derivatives as CXCR3 Receptor Modulators MERCK SHARP & DOHME CORP. 2010-11-11 US disclosed
US-20100286191-A1 2-Arylthiazole Derivatives as CXCR3 Receptor Modulators MERCK SHARP & DOHME CORP. 2010-11-11 US disclosed
WO-2007070433-A2 2-ARYLTHIAZOLE DERIVATIVES AS CXCR3 RECEPTOR MODULATORS MERCK & CO., INC. (US) 2007-06-21 WO 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-20100286191-A1 2-Arylthiazole Derivatives as CXCR3 Receptor Modulators CXCR3, CXCR1, CXCR2 GFER 2861/4885RAB9A 2780/4885SMN1; SMN2 4711/4885

“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.