SCHEMBL6134029

SCHEMBL6134029

CCCCn1nc(O)ccc1=O

nearest known ligand 0.64

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.42
ALDH1A1 P00352 2/20 0.40
LMNA P02545 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C19 P33261 1/20 0.40
PTGS2 P35354 1/20 0.39
ESR1 P03372 1/20 0.38
NR1H3 Q13133 1/20 0.37
USP2 O75604 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
SCHEMBL8149332 0.81 MAPT (0.36) HSD17B10ALDH1A1LMNACYP1A2CYP2C19
SCHEMBL10044416 0.80 PTGS2 (0.43) HSD17B10ALDH1A1LMNACYP1A2CYP2C19
SCHEMBL10044414 0.79 HSD17B10 (0.39) HSD17B10ALDH1A1LMNACYP1A2CYP2C19
SCHEMBL7803958 0.78 HSD17B10 (0.45) HSD17B10ALDH1A1LMNACYP1A2NR1H3
SCHEMBL18770684 0.74 KAT2B (0.42) HSD17B10ALDH1A1PTGS2
SCHEMBL8859418 0.74 HSD17B10 (0.44) HSD17B10ALDH1A1LMNACYP1A2CYP2C19
SCHEMBL11248494 0.72 LMNA (0.43) HSD17B10ALDH1A1LMNA
SCHEMBL23403285 0.70 KDM4E (0.45) ALDH1A1LMNAESR1NR1H3
SCHEMBL11393727 0.70 HSD17B10 (0.50) HSD17B10ALDH1A1USP2
SCHEMBL936893 0.70

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 HSD17B10 391/4885ALDH1A1 630/4885LMNA 4780/4885

“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.