SCHEMBL6135410

SCHEMBL6135410

COCCNC(=O)c1nc(-c2ccccc2)c(-c2ccc(=O)n(C(C)C)n2)s1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.44
HPGD P15428 3/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
ALDH1A1 P00352 5/20 0.41
KDM4E B2RXH2 3/20 0.41
ALOX15 P16050 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
POLB P06746 2/20 0.39
NPC1 O15118 2/20 0.39
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
LMNA P02545 1/20 0.38
DGAT1 O75907 1/20 0.37
SMN1; SMN2 Q16637 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
SCHEMBL6134311 0.90 HPGD (0.41) RAB9AHPGDALDH1A1KDM4EPOLB
SCHEMBL6133465 0.90 HSD17B10 (0.39) ALDH1A1KDM4EPOLBKMT2AMEN1
SCHEMBL6134990 0.89 MAPT (0.42) RAB9ACYP1A2CYP2C9CYP2C19ALDH1A1
SCHEMBL6133793 0.89 HSD17B10 (0.46) RAB9AKDM4EALOX15KMT2AMEN1
SCHEMBL6133811 0.88 NPC1 (0.40) HPGDALDH1A1KDM4EPOLBNPC1
SCHEMBL6924703 0.88 CAMK2D (0.42) HPGDCYP1A2KDM4EPOLBKMT2A
SCHEMBL6133161 0.87 L3MBTL1 (0.47) ALDH1A1L3MBTL1POLBNPC1KMT2A
SCHEMBL6133813 0.86 ALOX15 (0.46) ALDH1A1KDM4EALOX15POLBKMT2A
SCHEMBL6134295 0.86 TP53 (0.37) CYP1A2CYP2C9CYP2C19ALDH1A1KDM4E
SCHEMBL6134642 0.85 TP53 (0.41) RAB9AHPGDALDH1A1KDM4EALOX15

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 RAB9A 1067/4885HPGD 1177/4885CYP1A2 114/4885

“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.