SCHEMBL2783103

SCHEMBL2783103

COc1cc(/C=C/C(=O)Nc2ccccc2C(=O)O)ccc1C

nearest known ligand 0.83

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.83
KMT2A Q03164 4/20 0.83
ALDH1A1 P00352 4/20 0.83
HPGD P15428 4/20 0.83
NPC1 O15118 3/20 0.83
RAB9A P51151 3/20 0.83
SMN1; SMN2 Q16637 3/20 0.83
KDM4E B2RXH2 3/20 0.83
TP53 P04637 2/20 0.83
CYP3A4 P08684 2/20 0.83
HIF1A Q16665 2/20 0.83
NPSR1 Q6W5P4 2/20 0.83
PKM P14618 2/20 0.83
CYP1A2 P05177 1/20 0.83
CYP2C9 P11712 1/20 0.83
CYP2C19 P33261 1/20 0.83
HSD17B10 Q99714 1/20 0.83
ABCC4 O15439 1/20 0.83
HPGDS O60760 1/20 0.83
ABCB11 O95342 1/20 0.83

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
SCHEMBL2783104 1.00 MEN1 (0.83) MEN1KMT2AALDH1A1HPGDNPC1
Tranilast SCHEMBL30352530 0.91 MEN1 (1.00) MEN1KMT2AALDH1A1HPGDNPC1
Tranilast SCHEMBL29366319 0.91 MEN1 (1.00) MEN1KMT2AALDH1A1HPGDNPC1
Tranilast SCHEMBL30053800 0.91 MEN1 (1.00) MEN1KMT2AALDH1A1HPGDNPC1
Tranilast SCHEMBL29875 0.91 MEN1 (1.00) MEN1KMT2AALDH1A1HPGDNPC1
Tranilast SCHEMBL10978582 0.91 MEN1 (1.00) MEN1KMT2AALDH1A1HPGDNPC1
Tranilast SCHEMBL8696829 0.91 MEN1 (1.00) MEN1KMT2AALDH1A1HPGDNPC1
Tranilast SCHEMBL29876 0.91 MEN1 (1.00) MEN1KMT2AALDH1A1HPGDNPC1
Tranilast SCHEMBL29556872 0.91 MEN1 (1.00) MEN1KMT2AALDH1A1HPGDNPC1
SCHEMBL21024834 0.90 MEN1 (0.70) MEN1KMT2AALDH1A1HPGDNPC1

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-20100160351-A1 PHARMACEUTICAL COMPOSITIONS AND METHODS FOR TREATING HYPERURICEMIA AND RELATED DISORDERS NUON THERAPEUTICS, INC. (US) 2010-06-24 US claimed
EP-2173167-A2 TREATMENT OF NEUROPATHIC PAIN Nuon Therapeutics, Inc. (US) 2010-04-14 EP claimed
US-20100041756-A1 METHOD OF MODULATING B CELL FUNCTIONING IMPERIAL COLLEGE OF SCIENCE TECHNOLOGY & MEDICINE (GB) 2010-02-18 US claimed
US-20090312422-A1 METHOD OF MODULATING CELLULAR ACTIVITY AND AGENTS USEFUL FOR SAME EBERHARD-KARLS-UNIVERSITAET TUEBINGEN UNIVERSITAETSKLINIKUM 2009-12-17 US claimed
US-20090197957-A1 Methods and compositions for the treatment of pain NUON THERAPEUTICS, INC. 2009-08-06 US claimed
US-20090042987-A1 TREATMENT OF NEUROPATHIC PAIN NUON THERAPEUTICS INC. 2009-02-12 US claimed
WO-2009008997-A2 TREATMENT OF NEUROPATHIC PAIN NUON THERAPEUTICS, INC. (US) 2009-01-15 WO claimed
US-20080103204-A1 Method of modulating cellular activity and agents useful for same EBERHARD-KARLS-UNIVERSITAT TUBINGEN (DE) 2008-05-01 US claimed
US-20080009519-A1 METHOD OF MODULATING T CELL FUNCTIONING ANGIOGEN PHARMACEUTICALS PTY LIMITED (AU) 2008-01-10 US claimed
WO-2018144620-A9 ANTI-FIBROTIC COMPOUNDS CERTA THERAPEUTICS PTY LTD. (AU) 2019-01-24 WO disclosed
WO-2018144620-A1 ANTI-FIBROTIC COMPOUNDS SHIRE HUMAN GENETIC THERAPIES, INC. (US) 2018-08-09 WO disclosed
US-9561201-B2 Therapeutic compounds FIBROTECH THERAPEUTICS PTY LTD (AU) 2017-02-07 US disclosed
US-20120022116-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF PATHOLOGICAL CONDITION(S) RELATED TO GPR35 AND/OR GPR35-HERG COMPLEX CORNING INCORPORATED 2012-01-26 US disclosed
WO-2011047432-A1 FUSED RING ANALOGUES OF ANTI-FIBROTIC AGENTS FIBROTECH THERAPEUTICS PTY LTD (AU) 2011-04-28 WO disclosed
US-20090197957-A1 Methods and compositions for the treatment of pain NUON THERAPEUTICS, INC. 2009-08-06 US disclosed
US-7531575-B2 Method of modulating cellular activity and agents useful for same Eberhard-Karls-Universität Tübingin (DE) 2009-05-12 US disclosed
US-20090042987-A1 TREATMENT OF NEUROPATHIC PAIN NUON THERAPEUTICS INC. 2009-02-12 US disclosed
WO-2009008997-A2 TREATMENT OF NEUROPATHIC PAIN NUON THERAPEUTICS, INC. (US) 2009-01-15 WO disclosed
US-20080103204-A1 Method of modulating cellular activity and agents useful for same EBERHARD-KARLS-UNIVERSITAT TUBINGEN (DE) 2008-05-01 US disclosed
US-20080009519-A1 METHOD OF MODULATING T CELL FUNCTIONING ANGIOGEN PHARMACEUTICALS PTY LIMITED (AU) 2008-01-10 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 (8 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-20080103204-A1 Method of modulating cellular activity and agents useful for same NLN, GAP43, CYBB MEN1 3828/4885KMT2A 3579/4885ALDH1A1 1430/4885
US-20120022116-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF PATHOLOGICAL CONDITION(S) RELATED TO GPR35 AND/OR GPR35-HERG COMPLEX GPR35, GPR65, GPR68 MEN1 4026/4885KMT2A 4109/4885ALDH1A1 1572/4885
US-20100160351-A1 PHARMACEUTICAL COMPOSITIONS AND METHODS FOR TREATING HYPERURICEMIA AND RELATED DISORDERS XDH, SLC10A1, SLC10A6 MEN1 1944/4885KMT2A 3365/4885ALDH1A1 488/4885
US-20080009519-A1 METHOD OF MODULATING T CELL FUNCTIONING IFNG, CD4, IDO1 MEN1 3959/4885KMT2A 1759/4885ALDH1A1 1352/4885
US-20090197957-A1 Methods and compositions for the treatment of pain OPRL1, OPRK1, ACHE MEN1 3723/4885KMT2A 1934/4885ALDH1A1 312/4885
US-20090042987-A1 TREATMENT OF NEUROPATHIC PAIN OPRL1, GAP43, AANAT MEN1 3473/4885KMT2A 1821/4885ALDH1A1 1131/4885
US-20100041756-A1 METHOD OF MODULATING B CELL FUNCTIONING KYNU, IDO1, IDO2 MEN1 3204/4885KMT2A 1427/4885ALDH1A1 1104/4885
US-20090312422-A1 METHOD OF MODULATING CELLULAR ACTIVITY AND AGENTS USEFUL FOR SAME NLN, GAP43, CYBB MEN1 3828/4885KMT2A 3579/4885ALDH1A1 1430/4885

“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.