SCHEMBL487279

SCHEMBL487279

CCCc1ccc(C)nc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.50
TSHR P16473 2/20 0.50
GAA P10253 1/20 0.50
MEN1 O00255 2/20 0.47
LMNA P02545 2/20 0.47
KMT2A Q03164 2/20 0.47
NPC1 O15118 4/20 0.45
RAB9A P51151 4/20 0.45
TP53 P04637 3/20 0.45
PKM P14618 2/20 0.42
HSD17B10 Q99714 1/20 0.42
NFKB1 P19838 3/20 0.42
L3MBTL1 Q9Y468 3/20 0.42
KDM4E B2RXH2 2/20 0.42
ALDH1A1 P00352 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
MAPT P10636 1/20 0.42
ALOX15 P16050 1/20 0.42

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
SCHEMBL20749289 0.88 TSHR (0.55) SMN1; SMN2TSHRGAAMEN1LMNA
SCHEMBL1971057 0.87 NFKB1 (0.56) SMN1; SMN2TSHRGAAMEN1LMNA
SCHEMBL10347282 0.85 L3MBTL1 (0.56) SMN1; SMN2TSHRGAAMEN1LMNA
SCHEMBL30665032 0.85 L3MBTL1 (0.56) SMN1; SMN2TSHRGAAMEN1LMNA
SCHEMBL10144466 0.84 SMN1; SMN2 (0.51) SMN1; SMN2TSHRGAAMEN1LMNA
SCHEMBL23011835 0.84 RAB9A (0.55) SMN1; SMN2TSHRGAAMEN1LMNA
SCHEMBL487755 0.84 RAB9A (0.55) SMN1; SMN2TSHRGAAMEN1LMNA
SCHEMBL27433082 0.84 IDO1 (0.45) SMN1; SMN2TSHRGAAMEN1KMT2A
SCHEMBL17058993 0.84 RAB9A (0.55) SMN1; SMN2TSHRGAAMEN1LMNA
SCHEMBL31189295 0.82 GAA (0.55) SMN1; SMN2TSHRGAAMEN1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9328126-B2 Norbornenylhydrocarbylene dihydrocarbylboranes and methods of making the same PROMERUS, LLC (US) 2016-05-03 US claimed
US-20150353582-A1 NORBORNENYLHYDROCARBYLENE DIHYDROCARBYLBORANES AND METHODS OF MAKING THE SAME PROMERUS, LLC (US) 2015-12-10 US claimed
WO-2014121008-A1 NORBORNENYLHYDROCARBYLENE DIHYDROCARBYLBORANES AND METHODS OF MAKING THE SAME PROMERUS, LLC (US) 2014-08-07 WO claimed
US-8106200-B2 Pyridine borane complexes BASF SE (DE) 2012-01-31 US claimed
US-20110207934-A1 PYRIDINE BORANE COMPLEXES BASF SE (DE) 2011-08-25 US claimed
EP-2066631-B1 PYRIDINE BORANE COMPLEXES BASF SE (DE) 2011-04-06 EP claimed
US-11833229-B2 Labeling precursors with squaric acid coupling SCV SPEZIAL-CHEMIKALIEN-VERTRIEBS GMBH (DE) 2023-12-05 US disclosed
WO-2020155931-A1 JAK INHIBITOR AND PREPARATION METHOD THEREFOR 格格巫(珠海)生物科技有限公司 2020-08-06 WO disclosed
US-10660877-B2 Pyridyl substituted indole compounds BRISTOL-MYERS SQUIBB COMPANY (US) 2020-05-26 US disclosed
US-20190262311-A1 PYRIDYL SUBSTITUTED INDOLE COMPOUNDS BRISTOL MYERS SQUIBB CO (US) 2019-08-29 US disclosed
WO-2018128720-A1 URACIL CONTAINING COMPOUNDS CV6 THERAPEUTICS (NI) LIMITED (GB) 2018-07-12 WO disclosed
EP-2968288-B1 INHIBITORS OF THE RENAL OUTER MEDULLARY POTASSIUM CHANNEL MERCK SHARP & DOHME (US) 2018-07-04 EP disclosed
US-20170296539-A1 COMPOSITE PREPARATION, CONTAINING NOVEL 3-(4--(BENZYLOXY)PHENYL)HEX-4-INOIC ACID DERIVATIVE AND ANOTHER ACTIVE INGREDIENT, FOR PREVENTING OR TREATING METABOLIC DISEASES HYUNDAI PHARM CO., LTD. (KR) 2017-10-19 US disclosed
EP-2066631-A1 PYRIDINE BORANE COMPLEXES BASF SE (DE) 2009-06-10 EP disclosed
US-20090042919-A1 METHOD FOR MODULATING GPR119 G PROTEIN-COUPLED RECEPTOR AND SELECTED COMPOUNDS BRISTOL-MYERS SQUIBB COMPANY 2009-02-12 US disclosed
US-20090042919-A1 METHOD FOR MODULATING GPR119 G PROTEIN-COUPLED RECEPTOR AND SELECTED COMPOUNDS BRISTOL-MYERS SQUIBB COMPANY 2009-02-12 US disclosed
WO-2009012277-A1 METHOD FOR MODULATING GPR119 G PROTEIN-COUPLED RECEPTOR AND SELECTED COMPOUNDS BRISTOL-MYERS SQUIBB COMPANY (US) 2009-01-22 WO disclosed
WO-2008055859-A1 DIALKYLBORANE AMINE COMPLEXES BASF SE (DE) 2008-05-15 WO disclosed
WO-2008034886-A1 PYRIDINE BORANE COMPLEXES BASF SE (DE) 2008-03-27 WO disclosed
US-5009799-A Ethoxylated fatty amine and betaine inner salts, alkyne radical contining alcohol, pyridine quaternary ammonium salt NALCO CHEMICAL COMPANY (US) 1991-04-23 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 (7 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-20090042919-A1 METHOD FOR MODULATING GPR119 G PROTEIN-COUPLED RECEPTOR AND SELECTED COMPOUNDS GPR119, GPR65, GPR84 SMN1; SMN2 2497/4885TSHR 300/4885GAA 2267/4885
US-20190262311-A1 PYRIDYL SUBSTITUTED INDOLE COMPOUNDS TLR7, TLR9, TLR1 SMN1; SMN2 3902/4885TSHR 541/4885GAA 4741/4885
US-20150353582-A1 NORBORNENYLHYDROCARBYLENE DIHYDROCARBYLBORANES AND METHODS OF MAKING THE SAME CYP8B1, BDKRB1, CYP1B1 SMN1; SMN2 2340/4885TSHR 2733/4885GAA 4768/4885
US-10660877-B2 Pyridyl substituted indole compounds TLR7, TLR9, TLR1 SMN1; SMN2 3902/4885TSHR 541/4885GAA 4741/4885
US-20170296539-A1 COMPOSITE PREPARATION, CONTAINING NOVEL 3-(4--(BENZYLOXY)PHENYL)HEX-4-INOIC ACID DERIVATIVE AND ANOTHER ACTIVE INGREDIENT, FOR PREVENTING OR TREATING METABOLIC DISEASES SLC5A2, SLC5A1, DPP4 SMN1; SMN2 2750/4885TSHR 2311/4885GAA 112/4885
US-11833229-B2 Labeling precursors with squaric acid coupling SCLY, SRRT, CS SMN1; SMN2 1919/4885TSHR 149/4885GAA 37/4885
US-20110207934-A1 PYRIDINE BORANE COMPLEXES NBAS, BRD8, PAXBP1 SMN1; SMN2 3809/4885TSHR 3483/4885GAA 4566/4885

“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.