SCHEMBL7185606

SCHEMBL7185606

CCOC(=O)c1csc(N2CCCC2)n1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.62
KMT2A Q03164 3/20 0.62
LMNA P02545 3/20 0.62
MEN1 O00255 2/20 0.62
L3MBTL1 Q9Y468 2/20 0.62
HPGD P15428 2/20 0.62
POLB P06746 2/20 0.62
BLM P54132 1/20 0.62
ESR2 Q92731 1/20 0.62
OGA O60502 1/20 0.55
NPC1 O15118 5/20 0.55
RAB9A P51151 5/20 0.55
MAPT P10636 5/20 0.55
GAA P10253 2/20 0.53
SMN1; SMN2 Q16637 4/20 0.50
RXFP1 Q9HBX9 3/20 0.50
CYP1A2 P05177 1/20 0.50
CYP2C19 P33261 1/20 0.50
KDM4E B2RXH2 2/20 0.49
HSD17B10 Q99714 1/20 0.48

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
SCHEMBL10464669 0.99 ALDH1A1 (0.64) ALDH1A1KMT2ALMNAMEN1L3MBTL1
SCHEMBL10466693 0.89 OGA (0.56) ALDH1A1KMT2ALMNAMEN1L3MBTL1
SCHEMBL10464496 0.89 OGA (0.53) ALDH1A1KMT2ALMNAMEN1L3MBTL1
SCHEMBL5378395 0.88 OGA (0.53) ALDH1A1KMT2ALMNAMEN1L3MBTL1
SCHEMBL7173774 0.88 OGA (0.55) ALDH1A1KMT2ALMNAMEN1L3MBTL1
SCHEMBL5723882 0.87 OGA (0.52) ALDH1A1KMT2ALMNAMEN1L3MBTL1
SCHEMBL1118526 0.87 OGA (0.54) ALDH1A1KMT2ALMNAMEN1L3MBTL1
Hydrochloric Acid SCHEMBL2584196 0.87 MAPT (0.53) ALDH1A1KMT2ALMNAMEN1L3MBTL1
SCHEMBL3436232 0.86 RAB9A (0.55) ALDH1A1KMT2ALMNAMEN1L3MBTL1
SCHEMBL15888544 0.85 OGA (0.53) ALDH1A1KMT2ALMNAMEN1L3MBTL1

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 81 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11834452-B2 CXCR7 antagonists CHEMOCENTRYX, INC. (US) 2023-12-05 US disclosed
US-11834452-B2 CXCR7 antagonists CHEMOCENTRYX, INC. (US) 2023-12-05 US disclosed
US-11834452-B2 CXCR7 antagonists CHEMOCENTRYX, INC. (US) 2023-12-05 US disclosed
US-20220127272-A1 CXCR7 ANTAGONISTS CHEMOCENTRYX, INC. 2022-04-28 US disclosed
US-20220127272-A1 CXCR7 ANTAGONISTS CHEMOCENTRYX, INC. 2022-04-28 US disclosed
US-11059825-B2 CXCR7 antagonists CHEMOCENTRYX, INC. (US) 2021-07-13 US disclosed
US-11059825-B2 CXCR7 antagonists CHEMOCENTRYX, INC. (US) 2021-07-13 US disclosed
US-20200095251-A1 CXCR7 ANTAGONISTS CHEMOCENTRYX, INC. 2020-03-26 US disclosed
US-10287292-B2 CXCR7 antagonists CHEMOCENTRYX, INC. (US) 2019-05-14 US disclosed
US-10287292-B2 CXCR7 antagonists CHEMOCENTRYX, INC. (US) 2019-05-14 US disclosed
WO-1994014436-A1 RETROVIRAL PROTEASE INHIBITING COMPOUNDS ABBOTT LABORATORIES (US) 1994-07-07 WO disclosed
US-4904792-A N-thiazolymethylthioalkyl-N'-alkylamidines and related compounds ELI LILLY AND COMPANY (US) 1990-02-27 US disclosed
US-4760075-A Miticides ELI LILLY AND COMPANY (US) 1988-07-26 US disclosed
EP-0091220-B1 THIAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM ELI LILLY AND COMPANY (US) 1987-05-13 EP disclosed
EP-0049618-B1 IMPROVEMENTS IN OR RELATING TO 2,4-DISUBSTITUTED THIAZOLE DERIVATIVES ELI LILLY AND COMPANY (US) 1985-08-14 EP disclosed
US-4474794-A N-Thiazolylmethylthioalkyl-N1 -alkenyl (or alkynyl)guanidines and related compounds ELI LILLY AND COMPANY (US) 1984-10-02 US disclosed
EP-0091220-A2 Thiazole derivatives, process for their preparation and pharmaceutical compositions containing them ELI LILLY AND COMPANY (US) 1983-10-12 EP disclosed
US-4382090-A N-Thiazolylmethylthioalkyl-N'alkylamidines and related compounds ELI LILLY AND COMPANY (US) 1983-05-03 US disclosed
US-4375547-A ANTIHISTAMINES, 'I RECEPTOR ANTAGONISTS, ANTISECRETORY AGENTS ELI LILLY AND COMPANY (US) 1983-03-01 US disclosed
EP-0049618-A1 Improvements in or relating to 2,4-disubstituted thiazole derivatives ELI LILLY AND COMPANY (US) 1982-04-14 EP 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 (5 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-10287292-B2 CXCR7 antagonists CXCR1, CXCR5, CCR7 ALDH1A1 1699/4885KMT2A 4596/4885LMNA 4819/4885
US-11059825-B2 CXCR7 antagonists CXCR1, CXCR5, CCR7 ALDH1A1 1699/4885KMT2A 4596/4885LMNA 4819/4885
US-11834452-B2 CXCR7 antagonists CXCR1, CXCR5, CCR7 ALDH1A1 1699/4885KMT2A 4596/4885LMNA 4819/4885
US-20200095251-A1 CXCR7 ANTAGONISTS CXCR1, CXCR5, CCR7 ALDH1A1 1699/4885KMT2A 4596/4885LMNA 4819/4885
US-20220127272-A1 CXCR7 ANTAGONISTS CXCR1, CXCR5, CCR7 ALDH1A1 1699/4885KMT2A 4596/4885LMNA 4819/4885

“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.