SCHEMBL418564

SCHEMBL418564

Oc1ccc(-c2nc3ccccc3o2)cc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCHE P06276 4/20 0.73
NPC1 O15118 5/20 0.69
ESR1 P03372 4/20 0.69
ESR2 Q92731 4/20 0.69
RAB9A P51151 4/20 0.69
MEN1 O00255 2/20 0.69
KMT2A Q03164 2/20 0.69
ATM Q13315 1/20 0.69
HSPD1 P10809 1/20 0.66
PTPN1 P18031 1/20 0.66
PTPN5 P54829 1/20 0.66
HSPE1 P61604 1/20 0.66
ALDH1A1 P00352 3/20 0.63
HSD17B10 Q99714 3/20 0.63
KDM4E B2RXH2 2/20 0.63
HPGD P15428 2/20 0.63
SMN1; SMN2 Q16637 2/20 0.63
TP53 P04637 1/20 0.63
KDM6B O15054 1/20 0.61
KDM6A O15550 1/20 0.61

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
SCHEMBL27968982 0.98 BCHE (0.71) BCHENPC1ESR1ESR2RAB9A
SCHEMBL27929209 0.98 BCHE (0.71) BCHENPC1ESR1ESR2RAB9A
SCHEMBL27602613 0.98 BCHE (0.71) BCHENPC1ESR1ESR2RAB9A
2-Phenylbenzo[D]Oxazole SCHEMBL28146330 0.91 BCHE (0.62) BCHENPC1ESR1ESR2RAB9A
SCHEMBL31170 0.90 NPC1 (0.81) BCHENPC1RAB9AMEN1KMT2A
SCHEMBL17561646 0.90 ESR1 (0.81) BCHENPC1ESR1ESR2RAB9A
Methane SCHEMBL29265168 0.88 NPC1 (0.79) BCHENPC1RAB9AMEN1KMT2A
SCHEMBL31476 0.88 NPC1 (0.79) BCHENPC1RAB9AMEN1KMT2A
SCHEMBL29919334 0.87 NPC1 (0.71) BCHENPC1RAB9AMEN1KMT2A
SCHEMBL28146329 0.86 PTGS2 (0.66) BCHENPC1ESR1ESR2RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012108689-A2 NOVEL COMPOUND HAVING SKIN-WHITENING, ANTI-OXIDIZING AND PPAR ACTIVITIES AND MEDICAL USE THEREFOR 부산대학교 산학협력단 (KR) 2012-08-16 WO claimed
US-8063204-B2 Benzothiazole and benzoxazole linked pyrrolo[2,1-c] [1, 4] benzodiazepine hybrids as novel antitumour agents and process for the preparation thereof COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2011-11-22 US claimed
US-20100113771-A1 NOVEL BENZOTHIAZOLE AND BENZOXAZOLE LINKED PYRROLO[2,1-C] [1, 4] BENZODIAZEPINE HYBRIDS AS NOVEL ANTITUMOUR AGENTS AND PROCESS FOR THE PREPARATION THEREOF COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2010-05-06 US claimed
WO-2008099416-A2 NOVEL BENZOTHIAZOLE AND BENZOXAZOLE LINKED PYRROLO[2,1-C] [1, 4] BENZODIAZEPINE HYBRIDS AS NOVEL ANTITUMOUR AGENTS AND PROCESS FOR THE PREPARATION THEREOF COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2008-08-21 WO claimed
EP-0652273-B1 Organic material for electroluminescent device and electroluminescent device SHINKO ELECTRIC IND CO (JP) 1998-02-11 EP claimed
EP-0652273-A1 Organic material for electroluminescent device and electroluminescent device SHINKO ELECTRIC INDUSTRIES CO. LTD. (JP) 1995-05-10 EP claimed
US-20240180576-A1 MECHANOCHROMIC PRESSURE SENSOR FOR SAFE AND EFFECTIVE TISSUE HANDLING IN MINIMALLY INVASIVE SURGERY FONDAZIONE ISTITUTO ITALIANO DI TECNOLOGIA (IT) 2024-06-06 US disclosed
CN-112961102-B Metal complex and electron transport material using the same 大电株式会社 2024-03-12 CN disclosed
EP-4312851-A1 MECHANOCHROMIC PRESSURE SENSOR FOR SAFE AND EFFECTIVE TISSUE HANDLING IN MINIMALLY INVASIVE SURGERY Fondazione Istituto Italiano di Tecnologia (IT) 2024-02-07 EP disclosed
EP-3626699-B1 SSAO INHIBITOR SHANDONG DANHONG PHARMACEUTICAL CO LTD (CN) 2023-07-12 EP disclosed
CN-109689665-B Metal complex and electron transport material using the same 大电株式会社 2021-10-01 CN disclosed
US-20210198220-A1 SSAO INHIBITOR SHANDONG DANHONG PHARMACEUTICAL CO LTD (CN) 2021-07-01 US disclosed
CN-112961102-A Metal complex and electron transport material using the same 大电株式会社 2021-06-15 CN disclosed
US-4187213-A CONTAINING BENZOTHIAZOLE, BENZIMIDAZOLE, BENZOTHIAZOLE OR INDOLE RING AND PIPERIDINE RING EASTMAN KODAK COMPANY (US) 1980-02-05 US disclosed
US-4174321-A POLYMERIC MOLDING MATERIALS EASTMAN KODAK COMPANY (US) 1979-11-13 US disclosed
US-4127501-A BENZOXAZOLE, BENZOTHIAZOLE, BENZIMIDAZOLE, BENZOTRIAZOLE OR INDOLE DERIVATIVES EASTMAN KODAK COMPANY (US) 1978-11-28 US disclosed
US-4115348-A DEGRADATION INHIBITORS EASTMAN KODAK COMPANY (US) 1978-09-19 US disclosed
US-4065427-A Polychromophoric heterocyclic ultraviolet stabilizers and their use in organic compositions EASTMAN KODAK COMPANY (US) 1977-12-27 US disclosed
US-4046771-A GREENISH-YELLOW SHADES ON SYNTHETIC FIBERS BAYER AKTIENGESELLSCHAFT (DT) 1977-09-06 US disclosed
US-4000148-A POLYMERS EASTMAN KODAK COMPANY (US) 1976-12-28 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 (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-20100113771-A1 NOVEL BENZOTHIAZOLE AND BENZOXAZOLE LINKED PYRROLO[2,1-C] [1, 4] BENZODIAZEPINE HYBRIDS AS NOVEL ANTITUMOUR AGENTS AND PROCESS FOR THE PREPARATION THEREOF GABRA1, GABRA4, GABRA5 BCHE 3904/4885NPC1 2096/4885ESR1 2328/4885
US-20210198220-A1 SSAO INHIBITOR SSB, ASAH2, AOX1 BCHE 3796/4885NPC1 567/4885ESR1 4721/4885

“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.