SCHEMBL3267277

SCHEMBL3267277

Cc1cc(C)c2cc(C)[nH]c2c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 3/20 0.44
HSD17B10 Q99714 3/20 0.43
GRIN2D O15399 1/20 0.43
GRIN3B O60391 1/20 0.43
GRIN1 Q05586 1/20 0.43
GRIN2A Q12879 1/20 0.43
GRIN2B Q13224 1/20 0.43
GRIN2C Q14957 1/20 0.43
GRIN3A Q8TCU5 1/20 0.43
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
KDM4E B2RXH2 5/20 0.41
MAPT P10636 3/20 0.41
POLB P06746 2/20 0.40
ALDH1A1 P00352 4/20 0.39
GAA P10253 2/20 0.39
HPGD P15428 1/20 0.39
ALOX15 P16050 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
KIF11 P52732 1/20 0.38

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
SCHEMBL24219876 0.77 LMNA (0.43) RXFP1HSD17B10GRIN2DGRIN3BGRIN1
SCHEMBL22408216 0.77 LMNA (0.52) RXFP1HSD17B10GRIN1KDM4EMAPT
SCHEMBL29445923 0.77 KEAP1 (0.43) RXFP1HSD17B10GRIN2DGRIN3BGRIN1
SCHEMBL22408290 0.77 KEAP1 (0.43) RXFP1HSD17B10GRIN2DGRIN3BGRIN1
SCHEMBL8913242 0.77 SELL (0.42) RXFP1KDM4EMAPTALDH1A1GAA
SCHEMBL21983593 0.74 ACHE (0.45) RXFP1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL24102931 0.74 ALDH1A1 (0.39) RXFP1HSD17B10GRIN2DGRIN3BGRIN1
SCHEMBL24037986 0.73 MAOA (0.40) RXFP1NPC1RAB9AKDM4EMAPT
SCHEMBL3267266 0.73 KDM4E (0.43) RXFP1HSD17B10GRIN2DGRIN3BGRIN1
SCHEMBL27375824 0.73 KDM4E (0.40) RXFP1HSD17B10GRIN2DGRIN3BGRIN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1541553-B1 INDOLINE COMPOUND AND MEDICINAL USE THEREOF KYOTO PHARMA IND (JP) 2010-06-02 EP disclosed
US-7429612-B2 Indoline compound and medicinal use thereof KYOTO PHARMACEUTICAL INDUSTRIES, LTD. (JP) 2008-09-30 US disclosed
CN-100349868-C Indoline compound and medical use thereof KYOTO PHARMA IND (JP) 2007-11-21 CN disclosed
US-20060128787-A1 Novel indoline compound and medicinal use thereof KYOTO PHARMACEUTICAL INDUSTRIES, LTD. (JP) 2006-06-15 US disclosed
CN-1681781-A Novel indoline compound and medicinal use thereof KYOTO PHARMA IND (JP) 2005-10-12 CN disclosed
EP-1541553-A1 NOVEL INDOLINE COMPOUND AND MEDICINAL USE THEREOF Kyoto Pharmaceutical Industries, Ltd. (JP) 2005-06-15 EP disclosed
EP-0409949-B1 ARYLSULPHONYL-NITROMETHANES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS ICI PLC (GB) 1994-05-18 EP disclosed
US-5185452-A Antidiabetic agents; aldose reductase inhibitor IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1993-02-09 US disclosed
EP-0409949-A1 ARYLSULPHONYL-NITROMETHANES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS. ICI PLC (GB) 1991-01-30 EP disclosed
WO-1990008763-A1 ARYLSULPHONYL-NITROMETHANES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-08-09 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-20060128787-A1 Novel indoline compound and medicinal use thereof ACAT2, ACAT1, ACOX1 RXFP1 2989/4885HSD17B10 125/4885GRIN2D 3944/4885

“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.