SCHEMBL10747580

SCHEMBL10747580

CCOC(=O)c1cc(C)[nH]c1C

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.69
MAPT P10636 4/20 0.69
LMNA P02545 1/20 0.69
L3MBTL1 Q9Y468 1/20 0.69
GAA P10253 3/20 0.63
POLB P06746 2/20 0.63
NPC1 O15118 1/20 0.63
KDM4E B2RXH2 6/20 0.58
GLA P06280 1/20 0.58
ATM Q13315 1/20 0.58
KMT2A Q03164 3/20 0.57
MEN1 O00255 2/20 0.56
HSD17B10 Q99714 2/20 0.56
TP53 P04637 1/20 0.56
ALOX15 P16050 1/20 0.56
APOBEC3G Q9HC16 1/20 0.56
RXFP1 Q9HBX9 1/20 0.56
TSHR P16473 1/20 0.52
PDE3B Q13370 2/20 0.50
PDE3A Q14432 2/20 0.50

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
SCHEMBL11647465 0.83 ALDH1A1 (0.67) ALDH1A1MAPTLMNAL3MBTL1GAA
SCHEMBL23732252 0.83 ALDH1A1 (0.67) ALDH1A1MAPTLMNAL3MBTL1GAA
SCHEMBL3692361 0.81 KDM4E (0.55) ALDH1A1MAPTLMNAL3MBTL1GAA
SCHEMBL9671945 0.81 ALDH1A1 (1.00) ALDH1A1MAPTLMNAL3MBTL1GAA
SCHEMBL1317881 0.81 KDM4E (0.55) ALDH1A1MAPTLMNAL3MBTL1GAA
SCHEMBL23732254 0.81 KDM4E (0.55) ALDH1A1MAPTLMNAL3MBTL1GAA
SCHEMBL1157003 0.81 MAPT (0.65) ALDH1A1MAPTLMNAL3MBTL1GAA
SCHEMBL28289543 0.80 KDM4E (0.54) ALDH1A1MAPTLMNAL3MBTL1GAA
SCHEMBL30403242 0.80 ALDH1A1 (0.63) ALDH1A1MAPTLMNAL3MBTL1GAA
SCHEMBL78402 0.80 MAPT (0.55) ALDH1A1MAPTLMNAL3MBTL1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4070366-A RING ALKYLATION OF SUBSTITUTED PYRROLES, ONE STEP CANADIAN PATENTS & DEVELOPMENT LIMITED (US) 1978-01-24 US claimed
CN-109320499-B Pyrrole-3-formamide compound and preparation method and application thereof 沈阳药科大学 2020-09-08 CN disclosed
US-9695166-B2 Pyrazolopyridine pyrazolopyrimidine and related compounds GLOBAL BLOOD THERAPEUTICS, INC. (US) 2017-07-04 US disclosed
US-20150315198-A1 PYRAZOLOPYRIDINE PYRAZOLOPYRIMIDINE AND RELATED COMPOUNDS GLOBAL BLOOD THERAPEUTICS, INC. (US) 2015-11-05 US disclosed
CN-1422846-A Pyrrole derivative preparation method RES INST YANSHAN PETROCHEMICAL (CN) 2003-06-11 CN disclosed
EP-0230110-A1 Pharmacologically active pyrrole and pyrazole derivatives FISONS plc (GB) 1987-07-29 EP disclosed
US-4070366-A RING ALKYLATION OF SUBSTITUTED PYRROLES, ONE STEP CANADIAN PATENTS & DEVELOPMENT LIMITED (US) 1978-01-24 US 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-20150315198-A1 PYRAZOLOPYRIDINE PYRAZOLOPYRIMIDINE AND RELATED COMPOUNDS TPMT, DPYD, XDH ALDH1A1 416/4885MAPT 44/4885LMNA 3428/4885

“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.