SCHEMBL2246180

SCHEMBL2246180

Cc1ccc(-c2nc3cc(C(C)(C)C)ccc3o2)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 8/20 0.71
RAB9A P51151 8/20 0.71
ALDH1A1 P00352 8/20 0.71
KDM4E B2RXH2 7/20 0.71
SMN1; SMN2 Q16637 6/20 0.71
HPGD P15428 6/20 0.71
TP53 P04637 5/20 0.71
HSD17B10 Q99714 4/20 0.71
GFER P55789 2/20 0.68
MAPT P10636 5/20 0.64
NFKB1 P19838 4/20 0.64
NFKB2 Q00653 4/20 0.64
RELA Q04206 4/20 0.64
L3MBTL1 Q9Y468 2/20 0.64
LMNA P02545 1/20 0.64
POLB P06746 1/20 0.59
CASP3 P42574 1/20 0.59
SENP8 Q96LD8 1/20 0.59
SENP7 Q9BQF6 1/20 0.59
SENP6 Q9GZR1 1/20 0.59

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
SCHEMBL16800390 0.94 RAB9A (0.72) NPC1RAB9AALDH1A1KDM4ESMN1; SMN2
SCHEMBL14947174 0.94 NPC1 (0.75) NPC1RAB9AALDH1A1KDM4ESMN1; SMN2
SCHEMBL15745637 0.92 NPC1 (0.73) NPC1RAB9AALDH1A1KDM4ESMN1; SMN2
SCHEMBL3288472 0.92 NPC1 (0.78) NPC1RAB9AALDH1A1KDM4ESMN1; SMN2
SCHEMBL28331595 0.91 NPC1 (0.77) NPC1RAB9AALDH1A1KDM4ESMN1; SMN2
SCHEMBL10045308 0.88 NPC1 (0.68) NPC1RAB9AALDH1A1KDM4ESMN1; SMN2
SCHEMBL2242200 0.87 RAB9A (0.84) NPC1RAB9AALDH1A1KDM4ESMN1; SMN2
SCHEMBL3368896 0.87 ESR1 (0.69) NPC1RAB9AALDH1A1KDM4ESMN1; SMN2
SCHEMBL22103728 0.87 NPC1 (0.66) NPC1RAB9AALDH1A1KDM4ESMN1; SMN2
SCHEMBL2244484 0.87 NPC1 (0.66) NPC1RAB9AALDH1A1KDM4ESMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110195932-A1 Drug Combinations for the Treatment of Duchenne Muscular Dystrophy SUMMIT (OXFORD) LIMITED (GB) 2011-08-11 US claimed
EP-0280652-B1 PROCESS FOR INCREASING THE DEGREE OF WHITENESS OF TEXTILE MATERIAL CONTAINING A POLYESTER CIBA-GEIGY AG (CH) 1992-09-16 EP claimed
EP-0280652-A1 Process for increasing the degree of whiteness of textile material containing a polyester CIBA-GEIGY AG (CH) 1988-08-31 EP claimed
EP-3251694-A1 DRUG COMBINATIONS FOR THE TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY Summit (Oxford) Limited (GB) 2017-12-06 EP disclosed
US-20140018320-A1 TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY SUMMIT CORPORATION PLC (GB) 2014-01-16 US disclosed
US-20140011782-A1 DRUG COMBINATIONS FOR THE TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY SUMMIT CORPORATION PLC (GB) 2014-01-09 US disclosed
US-8518980-B2 Treatment of Duchenne muscular dystrophy SUMMIT CORPORATION PLC (GB) 2013-08-27 US disclosed
US-8501713-B2 Drug combinations for the treatment of duchenne muscular dystrophy SUMMIT CORPORATION PLC (GB) 2013-08-06 US disclosed
US-20110195932-A1 Drug Combinations for the Treatment of Duchenne Muscular Dystrophy SUMMIT (OXFORD) LIMITED (GB) 2011-08-11 US disclosed
US-7723114-B1 Methods and systems for detection of radionuclides CLEMSON UNIVERSITY (US) 2010-05-25 US disclosed
EP-2170396-A1 DRUG COMBINATIONS FOR THE TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY BioMarin IGA Limited (BS) 2010-04-07 EP disclosed
WO-2000077545-A1 IN-SITU RADIOACTIVITY DETECTION 3M INNOVATIVE PROPERTIES COMPANY (US) 2000-12-21 WO disclosed
US-6139749-A CONTACTING ENVIRONMENTAL FLUID WITH COMPOSITE SHEET MATERIAL COMPRISING SEPARATORS AND SCINTILLATORS ENTRAPPED IN POROUS MATRIX OR MEMBRANE 3M INNOVATIVE PROPERTIES COMPANY (US) 2000-10-31 US disclosed
EP-1032850-A1 SELF-SCINTILLATING SHEET MATERIAL FOR RADIOACTIVE SPECIES ANALYSIS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 2000-09-06 EP disclosed
WO-1999027387-A1 SELF-SCINTILLATING SHEET MATERIAL FOR RADIOACTIVE SPECIES ANALYSIS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1999-06-03 WO disclosed
EP-0280652-B1 PROCESS FOR INCREASING THE DEGREE OF WHITENESS OF TEXTILE MATERIAL CONTAINING A POLYESTER CIBA-GEIGY AG (CH) 1992-09-16 EP disclosed
US-4830763-A Process for increasing the degree of whiteness of polyester-containing textile material CIBA-GEIGY CORPORATION (US) 1989-05-16 US disclosed
EP-0280652-A1 Process for increasing the degree of whiteness of textile material containing a polyester CIBA-GEIGY AG (CH) 1988-08-31 EP disclosed
US-4261855-A OPTICAL BRIGHTENERS, FLUORESCENT DYES CIBA-GEIGY CORPORATION (US) 1981-04-14 US disclosed
US-4113937-A OPTICAL BRIGHTENERS CIBA-GEIGY CORPORATION (US) 1978-09-12 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 (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-20110195932-A1 Drug Combinations for the Treatment of Duchenne Muscular Dystrophy PYGM, CPT1B, GYS1 NPC1 2477/4885RAB9A 3748/4885ALDH1A1 1203/4885
US-20140011782-A1 DRUG COMBINATIONS FOR THE TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY PYGM, CPT1B, GYS1 NPC1 2477/4885RAB9A 3748/4885ALDH1A1 1203/4885
US-20140018320-A1 TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY NR0B1, NR0B2, NR3C1 NPC1 3637/4885RAB9A 4325/4885ALDH1A1 1652/4885

“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.