SCHEMBL448609

SCHEMBL448609

COC(=O)c1ccccc1NC(=O)C(C)Cl

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.65
TDP1 Q9NUW8 1/20 0.65
KDM4E B2RXH2 7/20 0.62
ALDH1A1 P00352 6/20 0.62
HPGD P15428 3/20 0.62
KMT2A Q03164 2/20 0.61
GAA P10253 4/20 0.59
POLB P06746 1/20 0.57
ATM Q13315 1/20 0.57
HSD17B10 Q99714 3/20 0.55
MAPT P10636 3/20 0.55
L3MBTL1 Q9Y468 2/20 0.55
MAPK1 P28482 1/20 0.55
USP2 O75604 2/20 0.54
LMNA P02545 1/20 0.54
HTT P42858 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
ALOX15 P16050 2/20 0.54
MEN1 O00255 1/20 0.54
CYP1A2 P05177 1/20 0.52

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
SCHEMBL5928724 0.87 TSHR (0.68) TSHRTDP1KDM4EALDH1A1HPGD
SCHEMBL25904137 0.84 TSHR (0.65) TSHRTDP1KDM4EALDH1A1HPGD
SCHEMBL449366 0.83 L3MBTL1 (0.58) TSHRTDP1KDM4EALDH1A1KMT2A
Hydrochloric Acid SCHEMBL7141648 0.81 KDM4E (0.63) TSHRTDP1KDM4EALDH1A1HPGD
SCHEMBL3860229 0.81 TSHR (0.66) TSHRTDP1KDM4EALDH1A1HPGD
SCHEMBL10362881 0.81 KDM4E (0.76) TSHRTDP1KDM4EALDH1A1HPGD
SCHEMBL15220622 0.81 L3MBTL1 (0.55) TSHRTDP1KDM4EALDH1A1KMT2A
SCHEMBL7401969 0.80 KMT2A (0.69) TSHRTDP1KDM4EALDH1A1HPGD
SCHEMBL13936399 0.79 KMT2A (0.73) TSHRTDP1KDM4EALDH1A1HPGD
SCHEMBL17115785 0.79 TSHR (0.63) TSHRTDP1KDM4EALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025015167-A2 ERASTIN KETONE ANALOGS AND USES THEREOF EXARTA THERAPEUTICS, INC. (US) 2025-01-16 WO disclosed
EP-2636669-B1 PYRAZOLE AMIDE COMPOUND AND USE THEREOF AS FUNGICIDE SINOCHEM CORP (CN) 2015-10-21 EP disclosed
US-8748440-B2 Quinazolinone modulators of nuclear receptors EXELIXIS, INC. (US) 2014-06-10 US disclosed
EP-2636669-A1 PYRAZOLE AMIDE COMPOUND AND USE THEREOF Sinochem Corporation (CN) 2013-09-11 EP disclosed
US-20130225585-A1 PYRAZOLE AMIDE COMPOUNDS AND USES THEREOF SHENYANG RESEARCH INSTITUTE OF CHEMICAL INDUSTRY CO., LTD. (CN) 2013-08-29 US disclosed
US-20120064025-A1 Quinazolinone Modulators Of Nuclear Receptors EXELIXIS, INC. (US) 2012-03-15 US disclosed
EP-1521746-B1 QUINAZOLINONE MODULATORS OF NUCLEAR RECEPTORS X CEPTOR THERAPEUTICS INC (US) 2011-04-27 EP disclosed
US-20080070864-A1 Quinazolinone Modulators Of Nuclear Receptors X-CEPTOR THERAPEUTICS, INC. (US) 2008-03-20 US disclosed
EP-1521746-A1 QUINAZOLINONE MODULATORS OF NUCLEAR RECEPTORS X-Ceptor Therapeutics, Inc. (US) 2005-04-13 EP disclosed
WO-2003106435-A1 FUSED-RING PYRIMIDIN-4(3H)-ONE DERIVATIVES, PROCESSES FOR THE PREPARATION AND USES THEREOF SANKYO COMPANY, LIMITED (JP) 2003-12-24 WO disclosed
WO-2003076418-A1 QUINAZOLINONE MODULATORS OF NUCLEAR RECEPTORS X-CEPTOR THERAPEUTICS, INC. (US) 2003-09-18 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 (3 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-20130225585-A1 PYRAZOLE AMIDE COMPOUNDS AND USES THEREOF BROX, OAT, CAT TSHR 3562/4885TDP1 4236/4885KDM4E 2723/4885
US-20120064025-A1 Quinazolinone Modulators Of Nuclear Receptors NR1H4, NR1H2, NR1H3 TSHR 518/4885TDP1 4440/4885KDM4E 3717/4885
US-20080070864-A1 Quinazolinone Modulators Of Nuclear Receptors NR1H4, NR1H2, NR1H3 TSHR 518/4885TDP1 4440/4885KDM4E 3717/4885

“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.