SCHEMBL196177

SCHEMBL196177

CCCCC1=CCCCC1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.49
ALOX15 P16050 2/20 0.49
PKM P14618 1/20 0.44
SMN1; SMN2 Q16637 3/20 0.41
RAB9A P51151 2/20 0.41
USP2 O75604 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
KMT2A Q03164 3/20 0.39
MEN1 O00255 2/20 0.39
PSMB5 P28074 1/20 0.39
TAAR1 Q96RJ0 1/20 0.39
NPC1 O15118 1/20 0.39
HTT P42858 1/20 0.39

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
SCHEMBL7991234 0.98 ALDH1A1 (0.47) ALDH1A1ALOX15PKMSMN1; SMN2RAB9A
SCHEMBL11241473 0.98 ALDH1A1 (0.47) ALDH1A1ALOX15PKMSMN1; SMN2RAB9A
SCHEMBL7991295 0.98 ALDH1A1 (0.47) ALDH1A1ALOX15PKMSMN1; SMN2RAB9A
SCHEMBL724520 0.94 ALDH1A1 (0.47) ALDH1A1ALOX15PKMSMN1; SMN2RAB9A
SCHEMBL316396 0.93
SCHEMBL60610 0.92 ALDH1A1 (0.46) ALDH1A1ALOX15PKMSMN1; SMN2RAB9A
SCHEMBL11236833 0.92 ALDH1A1 (0.46) ALDH1A1ALOX15PKMSMN1; SMN2RAB9A
SCHEMBL61669 0.92 ALDH1A1 (0.46) ALDH1A1ALOX15PKMSMN1; SMN2RAB9A
SCHEMBL11236830 0.92 ALDH1A1 (0.46) ALDH1A1ALOX15PKMSMN1; SMN2RAB9A
SCHEMBL6839659 0.92 ALDH1A1 (0.46) ALDH1A1ALOX15PKMSMN1; SMN2RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11352321-B2 Glucagon antagonists METABASIS THERAPEUTICS, INC. (US) 2022-06-07 US claimed
EP-3154956-A1 GLUCAGON ANTAGONISTS Ligand Pharmaceuticals, Inc. (US) 2017-04-19 EP claimed
WO-2015191900-A1 GLUCAGON ANTAGONISTS LIGAND PHARMACEUTICALS, INC. (US) 2015-12-17 WO claimed
EP-2046147-B1 METHOD OF USING ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2013-05-01 EP claimed
JP-2012500212-A 2012-01-05 JP claimed
EP-2326618-A1 GLUCAGON ANTAGONISTS Metabasis Therapeutics, Inc. (US) 2011-06-01 EP claimed
WO-2010019830-A1 GLUCAGON ANTAGONISTS METABASIS THERAPEUTICS, INC. (US) 2010-02-18 WO claimed
US-20090311403-A1 Method of Using Organic Compounds GIVAUDAN SA (CH) 2009-12-17 US claimed
EP-2046147-A1 METHOD OF USING ORGANIC COMPOUNDS Givaudan SA (CH) 2009-04-15 EP claimed
WO-2008011742-A1 METHOD OF USING ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2008-01-31 WO claimed
EP-0227241-B1 Medicinal indole and indazole keto sulphone derivatives ZENECA INC (US) 1996-09-11 EP claimed
US-5234942-A Treating allergic pulmonary disorders, asthma ICI AMERICAS INC. (US) 1993-08-10 US claimed
EP-0242167-B1 HETEROCYCLIC CARBOXAMIDES ICI AMERICAS INC. (US) 1991-11-27 EP claimed
US-4997844-A Compounds for the treatment of allergic or inflammatory diseases or shock conditions ICI AMERICAS INC. (US) 1991-03-05 US claimed
EP-0179619-B1 HETEROCYCLIC AMIDES ICI AMERICAS INC. (US) 1990-09-05 EP claimed
US-4898863-A Heterocyclic carboxamides ICI AMERICAS INC. (US) 1990-02-06 US claimed
US-4837235-A ANTIALLERGENS, ANTIINFLAMMATORY AGENTS ICI AMERICAS INC. (US) 1989-06-06 US claimed
EP-0242167-A2 Heterocyclic carboxamides ICI AMERICAS INC. (US) 1987-10-21 EP claimed
EP-0227241-A2 Medicinal indole and indazole keto sulphone derivatives ZENECA INC. (US) 1987-07-01 EP claimed
US-3987069-A BORON PHOSPHATE CATALYST PETRO-TEX CHEMICAL CORPORATION (US) 1976-10-19 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 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-20090311403-A1 Method of Using Organic Compounds MGLL, GK, LIPC ALDH1A1 788/4885ALOX15 448/4885PKM 310/4885
US-11352321-B2 Glucagon antagonists GLP1R, GCG, GCGR ALDH1A1 3771/4885ALOX15 3383/4885PKM 1208/4885

“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.