SCHEMBL1036359

SCHEMBL1036359

c1ccc(NC2=NCCN2)cc1

nearest known ligand 0.78

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ADRA2A P08913 18/20 0.78
▸ ADRA2B P18089 18/20 0.78
▸ ADRA2C P18825 18/20 0.78
▸ PTGIR P43119 1/20 0.73
▸ ADRA1D P25100 2/20 0.59
▸ ADRA1A P35348 2/20 0.59
▸ ADRA1B P35368 2/20 0.59

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
SCHEMBL11180468 0.96 ADRA2A (0.85) ADRA2AADRA2BADRA2CPTGIRADRA1D
SCHEMBL11283477 0.89 ADRA2A (0.61) ADRA2AADRA2BADRA2CPTGIR
Benzaldehyde SCHEMBL5084142 0.87 ADRA2A (0.60) ADRA2AADRA2BADRA2CPTGIRADRA1D
Benzophenone SCHEMBL5084127 0.87 ADRA2A (0.80) ADRA2AADRA2BADRA2CPTGIR
SCHEMBL11162946 0.85 NISCH (0.59) ADRA2AADRA2BADRA2CPTGIRADRA1D
SCHEMBL11163847 0.85 ADRA2A (0.88) ADRA2AADRA2BADRA2CPTGIR
SCHEMBL5802197 0.85 PTGIR (1.00) ADRA2AADRA2BADRA2CPTGIR
SCHEMBL5803227 0.85 ADRA2A (0.88) ADRA2AADRA2BADRA2CPTGIR
SCHEMBL13017193 0.85 ADRA2A (0.88) ADRA2AADRA2BADRA2CPTGIRADRA1D
Hydrochloric Acid SCHEMBL11166308 0.84 ADRA2A (0.85) ADRA2AADRA2BADRA2CPTGIR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2276472-B1 COMPOSITIONS COMPRISING WEAKLY BASIC DRUGS AND CONTROLLED-RELEASE DOSAGE FORMS ADARE PHARMACEUTICALS INC (US) 2018-11-21 — — EP claimed
CN-104874021-A Method for preparing forging bone for surgical implantation BEIJING AOSITESAI MEDICAL TECHNOLOGY CO LTD 2015-09-02 — — CN claimed
CN-102006862-A Compositions and controlled release dosage forms comprising weakly basic drugs EURAND INC 2011-04-06 — — CN claimed
EP-2276472-A1 COMPOSITIONS COMPRISING WEAKLY BASIC DRUGS AND CONTROLLED-RELEASE DOSAGE FORMS Eurand, Inc. (US) 2011-01-26 — — EP claimed
WO-2009129282-A1 COMPOSITIONS COMPRISING WEAKLY BASIC DRUGS AND CONTROLLED-RELEASE DOSAGE FORMS EURAND INC (US) 2009-10-22 — — WO claimed
US-20090258066-A1 COMPOSITIONS COMPRISING WEAKLY BASIC DRUGS AND CONTROLLED-RELEASE DOSAGE FORMS ADARE PHARMACEUTICALS USA, INC. 2009-10-15 — — US claimed
EP-0821585-B1 USE OF ALPHA 1L-AGONISTS IN THE TREATMENT OF URINARY INCONTINENCE BOEHRINGER INGELHEIM PHARMA (DE) 2007-01-10 — — EP claimed
US-20030114425-A1 Compounds and methods for treating urinary incontinence BOEHRINGER INGELHEIM PHARMA KG (DE) 2003-06-19 — — US claimed
US-20020040150-A1 SKIN TREATMENT COMPOSITONS CONTAINING A CATIONIC POLYMER AND A MICROPARTICLE OR NANOPARTICLE VECTOR ESSER FRANZ (DE) 2002-04-04 — — US claimed
CN-1180311-A Use of 'alpha' 1L agonists in treatment of incontinence BOEHRINGER INGELHEIM KG (DE) 1998-04-29 — — CN claimed
EP-0029505-B1 SUBSTITUTED PHENYLAMINO-2-IMIDAZOLINE-2 DERIVATIVES, THEIR ACID ADDITION SALTS, MEDICAMENTS CONTAINING THEM AND PROCESS FOR THEIR PREPARATION C.H. BOEHRINGER SOHN (DE) 1984-09-12 — — EP claimed
EP-0030620-B1 SUBSTITUTED 2-PHENYLAMINO-2-IMIDAZOLINES, ACID ADDITION SALTS THEREOF, MEDICAMENTS CONTAINING THEM AND PROCESS FOR PREPARING THEM C.H. BOEHRINGER SOHN (DE) 1984-06-13 — — EP claimed
EP-0030616-B1 SUBSTITUTED 2-PHENYLAMINO-2-IMIDAZOLINES, THEIR ACID ADDITION SALTS, MEDICAMENTS CONTAINING THEM AND PROCESSES FOR PREPARING SAME C.H. BOEHRINGER SOHN (DE) 1984-01-11 — — EP claimed
US-4262006-A BRADYCARDIZING ACTIVITY, HYPOTENSIVE, DIURETIC ISTITUTO LUSOFARMACO D'ITALIA S.P.A. (IT) 1981-04-14 — — US claimed
CN-112472715-B Sodium bicarbonate enteric capsule and preparation method thereof 华熙生物科技股份有限公司 2023-06-23 — — CN disclosed
CN-112472715-A Sodium bicarbonate enteric-coated capsule and preparation method thereof 华熙生物科技股份有限公司 2021-03-12 — — CN disclosed
US-10583195-B2 Conjugate with target-finding ligand and use thereof ETHRIS GMBH (DE) 2020-03-10 — — US disclosed
US-3998956-A Pharmaceutical compositions containing a 1-(thienyl-methyl)-2-anilino-2-imidazoline and method of use BOEHRINGER INGELHEIM GMBH (DT) 1976-12-21 — — US disclosed
US-3950523-A ANTIDEPRESSANTS BOEHRINGER INGELHEIM GMBH (DT) 1976-04-13 — — US disclosed
US-3717633-A 2-ANILINO-1,3-DIAZACYCLOPENTENE-(2) DERIVATIVE BOEHRINGER SOHN INGELHEIM 1973-02-20 — — 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-20030114425-A1 Compounds and methods for treating urinary incontinence PDE3A, PDE3B, PDE2A ADRA2A 16/4885ADRA2B 14/4885ADRA2C 12/4885
US-20020040150-A1 SKIN TREATMENT COMPOSITONS CONTAINING A CATIONIC POLYMER AND A MICROPARTICLE OR NANOPARTICLE VECTOR COL1A1, TPSAB1, TACR1 ADRA2A 55/4885ADRA2B 86/4885ADRA2C 127/4885

“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.

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