Sugi Predict

Sugi Predict / Compounds / SCHEMBL4464646

SCHEMBL4464646

SCHEMBL4464646

Brc1ccc(-n2ccc3ccccc32)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BIRC5 O15392 1/20 0.67
▸ KMT2A Q03164 3/20 0.49
▸ HTT P42858 2/20 0.49
▸ MEN1 O00255 2/20 0.49
▸ PKM P14618 1/20 0.49
▸ L3MBTL1 Q9Y468 1/20 0.49
▸ PRKD3 O94806 1/20 0.46
▸ PRKCG P05129 1/20 0.46
▸ PRKCB P05771 1/20 0.46
▸ PRKCA P17252 1/20 0.46
▸ PRKACA P17612 1/20 0.46
▸ PRKACG P22612 1/20 0.46
▸ PRKACB P22694 1/20 0.46
▸ PRKCH P24723 1/20 0.46
▸ PRKCI P41743 1/20 0.46
▸ PRKCE Q02156 1/20 0.46
▸ PRKCQ Q04759 1/20 0.46
▸ PRKCZ Q05513 1/20 0.46
▸ PRKCD Q05655 1/20 0.46
▸ PRKD1 Q15139 1/20 0.46

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
SCHEMBL29367108 1.00 BIRC5 (0.67) BIRC5KMT2AHTTMEN1PKM
SCHEMBL15138702 0.94 BIRC5 (0.61) BIRC5KMT2AHTTMEN1PKM
SCHEMBL13242029 0.83 BIRC5 (0.71) BIRC5KMT2APRKD3PRKCGPRKCB
SCHEMBL170890 0.83 BIRC5 (0.70) BIRC5KMT2AHTTMEN1L3MBTL1
SCHEMBL29475118 0.83 BIRC5 (0.70) BIRC5KMT2AHTTMEN1L3MBTL1
SCHEMBL16600098 0.82 BIRC5 (0.55) BIRC5KMT2AHTTMEN1PKM
Hydrochloric Acid SCHEMBL3803742 0.81 BIRC5 (0.68) BIRC5KMT2AHTTMEN1L3MBTL1
SCHEMBL3194559 0.80 BIRC5 (0.67) BIRC5PRKD3PRKCGPRKCBPRKCA
SCHEMBL4426563 0.80 BIRC5 (0.67) BIRC5KMT2AHTTL3MBTL1PRKD3
SCHEMBL13483654 0.80 BIRC5 (0.67) BIRC5PRKD3PRKCGPRKCBPRKCA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107522648-B A kind of synthetic method of 3- alpha-difluoromethyl-α-trifluoromethyl-methanol-based indoles and its derivative 福州大学 2019-10-15 — — CN disclosed
CN-107522648-A A kind of synthetic method of 3 α difluoromethyls α trifluoromethyl carbinol groups indoles and its derivative 福州大学 2017-12-29 — — CN disclosed
WO-2015133807-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME 주식회사 두산 2015-09-11 — — WO disclosed
WO-2013176402-A1 INDOLE COMPOUND, COMPOUND FOR ORGANIC ELECTRIC ELEMENT CONTAINING DERIVATIVE THEREOF, ORGANIC ELECTRIC ELEMENT USING SAME, AND CORRESPONDING ELECTRONIC DEVICE 덕산하이메탈(주) (KR) 2013-11-28 — — WO disclosed
US-7524878-B2 Phenyl substituted carboxylic acids THE INSTITUTE FOR PHARMACEUTICALS DISCOVERY LLC (US) 2009-04-28 — — US disclosed
US-7465825-B2 Phenyl substituted carboxylic acids THE INSTITUTE FOR PHARMACEUTICAL DISCOVERY, LLC (US) 2008-12-16 — — US disclosed
US-7465825-B2 Phenyl substituted carboxylic acids THE INSTITUTE FOR PHARMACEUTICAL DISCOVERY, LLC (US) 2008-12-16 — — US disclosed
US-7465825-B2 Phenyl substituted carboxylic acids THE INSTITUTE FOR PHARMACEUTICAL DISCOVERY, LLC (US) 2008-12-16 — — US disclosed
US-20080146574-A1 Heterocycle Substituted Carboxylic Acids THE INSTITUTE FOR PHARMACEUTICAL DISCOVERY LLC 2008-06-19 — — US disclosed
US-7329680-B2 Heterocycle substituted carboxylic acids THE INSTITUTE FOR PHARMACEUTICAL DISCOVERY, LLC (US) 2008-02-12 — — US disclosed
EP-1628970-A2 HETEROCYCLE SUBSTITUTED CARBOXYLIC ACIDS AS INHIBITORS OF PROTEIN TYROSINE PHOSPHATASE-1B The Institutes of Pharmaceutical Discovery, LLC (US) 2006-03-01 — — EP disclosed
CN-1733723-A Indole and dihydroindole derivatives HOFFMANN LA ROCHE (CH) 2006-02-15 — — CN disclosed
EP-1620422-A2 PHENYL SUBSTITUTED CARBOXYLIC ACIDS AS INHIBITORS OF PROTEIN TYROSINE PHOSPHATASE-1B The Institutes for Pharmaceutical Discovery, LLC (US) 2006-02-01 — — EP disclosed
US-20050004369-A1 Phenyl substituted carboxylic acids INSTITUTES FOR PHARMACEUTICAL DISCOVERY, L.L.C. 2005-01-06 — — US disclosed
US-20050004114-A1 Heterocycle substituted carboxylic acids INSTITUTE FOR DIABETES DISCOVERY, L.L.C. 2005-01-06 — — US disclosed
WO-2004099192-A2 HETEROCYCLE SUBSTITUTED CARBOXYLIC ACIDS AS INHIBITORS OF PROTEIN TYROSINE PHOSPHATASE-1B THE INSTITUTES OF PHARMACEUTICAL DISCOVERY, LLC (US) 2004-11-18 — — WO disclosed
WO-2004099170-A2 PHENYL SUBSTITUTED CARBOXYLIC ACIDS AS INHIBITORS OF PROTEIN TYROSINE PHOSPHATASE-1B THE INSTITUTES FOR PHARMACEUTICAL DISCOVERY, LLC (US) 2004-11-18 — — WO disclosed
CN-1476432-A indole and indoline derivatives - 2004-02-18 — — CN disclosed
EP-1349833-A1 INDOLE AND DIHYDROINDOLE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2003-10-08 — — EP disclosed
WO-2002044149-A1 INDOLE AND DIHYDROINDOLE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2002-06-06 — — 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 (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-20050004114-A1 Heterocycle substituted carboxylic acids PTPRC, PTPRS, PTPRJ BIRC5 400/4885KMT2A 2597/4885HTT 263/4885
US-20080146574-A1 Heterocycle Substituted Carboxylic Acids PTPRC, PTPRS, PTPRJ BIRC5 400/4885KMT2A 2597/4885HTT 263/4885
US-20050004369-A1 Phenyl substituted carboxylic acids PTPA, PTPRS, PTPRO BIRC5 846/4885KMT2A 1897/4885HTT 455/4885

“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.