SCHEMBL6134413

SCHEMBL6134413

CC(C)n1nc(-c2sc(NC(=O)CCl)nc2-c2ccc(F)cc2)ccc1=O

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.40
ALDH1A1 P00352 3/20 0.40
KDM4E B2RXH2 2/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
HTT P42858 1/20 0.40
LMNA P02545 2/20 0.39
MAPT P10636 2/20 0.39
HPGD P15428 2/20 0.39
POLB P06746 1/20 0.39
BLM P54132 1/20 0.39
PKM P14618 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
KCNH2 Q12809 2/20 0.39
ADORA2A P29274 4/20 0.38
ADORA1 P30542 4/20 0.38
EGFR P00533 2/20 0.37
XIAP P98170 2/20 0.36

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
SCHEMBL6133361 0.90 ADORA2A (0.48) ALDH1A1KDM4EMEN1KMT2AHTT
SCHEMBL6133441 0.88 ALDH1A1 (0.47) ACHEALDH1A1KDM4EMEN1KMT2A
SCHEMBL6134330 0.85 ACHE (0.50) ACHEKCNH2ADORA2AADORA1
SCHEMBL6133159 0.84 ADORA2A (0.53) ALDH1A1KDM4EMEN1KMT2AHTT
Hydrochloric Acid SCHEMBL6133747 0.84 ALDH1A1 (0.51) ALDH1A1MEN1KMT2AHTTMAPT
SCHEMBL6133428 0.83 ALDH1A1 (0.47) ALDH1A1KDM4EKMT2AHTTLMNA
SCHEMBL6133257 0.82 SMN1; SMN2 (0.56) ALDH1A1KDM4EMEN1KMT2AHTT
SCHEMBL6135077 0.81 ADORA2A (0.36) ACHEALDH1A1PKMHDAC6KCNH2
SCHEMBL6133306 0.81 ADORA1 (0.60) ALDH1A1KDM4EMEN1KMT2AHTT
SCHEMBL6133290 0.80 ADORA2A (0.58) ADORA2AADORA1XIAP

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-20050004134-A1 Thiazole derivative and pharmaceutical use thereof ASTELLAS PHARMA INC. (JP) 2005-01-06 US disclosed
EP-1441732-A2 THIAZOLE DERIVATIVE AND PHARMACEUTICAL USE THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-08-04 EP disclosed
WO-2003039451-A2 THIAZOLE PYRIDAZINONES AS ADENOSINE ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-05-15 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-20050004134-A1 Thiazole derivative and pharmaceutical use thereof MC2R, CYP2C9, OXTR ACHE 3391/4885ALDH1A1 630/4885KDM4E 3814/4885

“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.