SCHEMBL4969852

SCHEMBL4969852

CC(C)C1Sc2ccccc2NC1=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.51
GAA P10253 1/20 0.51
HSD17B10 Q99714 5/20 0.50
KDM4E B2RXH2 3/20 0.50
ALDH1A1 P00352 3/20 0.50
TDP1 Q9NUW8 2/20 0.50
HTT P42858 2/20 0.50
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
HPGD P15428 2/20 0.50
BRD4 O60885 1/20 0.50
CREBBP Q92793 1/20 0.50
GLA P06280 1/20 0.50
USP2 O75604 1/20 0.50
ESR1 P03372 1/20 0.50
POLB P06746 1/20 0.50
THRB P10828 1/20 0.50
ALOX15 P16050 1/20 0.50
PTPN7 P35236 1/20 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
SCHEMBL10358553 0.83 KDM4E (0.51) MAPTGAAHSD17B10KDM4EALDH1A1
SCHEMBL9802392 0.79 MAPT (0.45) MAPTGAAHSD17B10KDM4EALDH1A1
SCHEMBL23775714 0.79 MAPT (0.39) MAPTGAAHSD17B10KDM4EALDH1A1
SCHEMBL7985003 0.79 ALDH1A1 (0.50) MAPTGAAHSD17B10KDM4EALDH1A1
SCHEMBL2745305 0.78 CREBBP (0.57) MAPTHSD17B10KDM4EALDH1A1TDP1
SCHEMBL24125191 0.78 CREBBP (0.57) MAPTHSD17B10KDM4EALDH1A1TDP1
SCHEMBL4328480 0.77 HSD17B10 (0.56) MAPTGAAHSD17B10KDM4EALDH1A1
SCHEMBL10359125 0.76 HSD11B1 (0.41) MAPTGAAHSD17B10KDM4EALDH1A1
SCHEMBL8853752 0.75 CREBBP (0.54) MAPTHSD17B10KDM4EALDH1A1TDP1
SCHEMBL4325934 0.74 HSD17B10 (0.53) MAPTGAAHSD17B10KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1985297-A1 CARBOXYLIC ACID COMPOUND AND USE THEREOF Japan Tobacco, Inc. (JP) 2008-10-29 EP disclosed
US-20070197512-A1 Carboxylic Acid Compounds and Use Thereof JAPAN TOBACCO INC. (JP) 2007-08-23 US disclosed
EP-0980362-B1 SUBSTITUTED HETEROCYCLES AND THEIR USE IN MEDICAMENTS SCHERING AG (DE) 2006-08-16 EP disclosed
US-6191127-B1 ANTIINFLAMMATORY AGENTS, AUTOIMMUNE DISEASES, CARDIOVASCULAR DISORDERS, NERVOUS SYSTEM DISORDERS SCHERING AKTIENGESELLSCHAFT (DE) 2001-02-20 US disclosed
EP-0980362-A1 SUBSTITUTED HETEROCYCLES AND THEIR USE IN MEDICAMENTS SCHERING AKTIENGESELLSCHAFT (DE) 2000-02-23 EP disclosed
WO-1998050372-A1 SUBSTITUTED HETEROCYCLES AND THEIR USE IN MEDICAMENTS SCHERING AKTIENGESELLSCHAFT (DE) 1998-11-12 WO disclosed
EP-0243018-B1 THIOLACTAM-N-ACETIC ACID DERIVATIVES, THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 1990-10-24 EP disclosed
US-4771050-A ALDOSE REDUCTASE INHIBITOR, ANTICOAGULANTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1988-09-13 US disclosed
EP-0243018-A1 Thiolactam-N-acetic acid derivatives, their production and use Takeda Chemical Industries, Ltd. (JP) 1987-10-28 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 (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-20070197512-A1 Carboxylic Acid Compounds and Use Thereof GLS, SLC10A1, SOAT1 MAPT 387/4885GAA 783/4885HSD17B10 380/4885

“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.