Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL905808

CCCN1CCc2ccc(C(F)(F)F)cc21.N

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
NOTUM Q6P988 1/20 0.43
CNR2 P34972 1/20 0.41
XIAP P98170 1/20 0.41
BIRC2 Q13490 1/20 0.41
DRD2 P14416 2/20 0.40
ALOX15 P16050 2/20 0.40
USP2 O75604 1/20 0.40
CDK4 P11802 1/20 0.40
CCND1 P24385 1/20 0.40
MAPT P10636 3/20 0.38
NPC1 O15118 2/20 0.38
MAPK1 P28482 2/20 0.38
RAB9A P51151 2/20 0.38
NPSR1 Q6W5P4 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
KDM4E B2RXH2 2/20 0.38
HTR2A P28223 3/20 0.38

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
SCHEMBL10311205 0.98 ALDH1A1 (0.44) ALDH1A1MEN1KMT2ANOTUMCNR2
SCHEMBL14260768 0.86 NOTUM (0.46) NOTUMCNR2XIAPBIRC2MAPT
SCHEMBL7833297 0.81 HTR2A (0.42) ALDH1A1MEN1KMT2ANOTUMCNR2
Ammonia Solution, Strong SCHEMBL905865 0.78 ALDH1A1 (0.47) ALDH1A1MEN1KMT2ANOTUMXIAP
SCHEMBL19173539 0.78 CHRM2 (0.54) ALDH1A1MEN1KMT2ANOTUMXIAP
SCHEMBL2625800 0.78 NOTUM (0.49) ALDH1A1MEN1KMT2ANOTUMCNR2
SCHEMBL11989094 0.78 HRH3 (0.48) ALDH1A1MEN1KMT2ANOTUMCNR2
SCHEMBL905806 0.77 HTR2A (0.64) NOTUMCNR2XIAPBIRC2NPSR1
Ammonia Solution, Strong SCHEMBL905757 0.77 HTR2A (0.60) ALDH1A1MEN1KMT2AXIAPBIRC2
Ammonia Solution, Strong SCHEMBL905978 0.77 HTR2A (0.60) ALDH1A1MEN1KMT2ANOTUMXIAP

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6380238-B1 FOR THERAPY OF DISORDERS OF THE CENTRAL NERVOUS SYSTEM; DAMAGE TO THE CENTRAL NERVOUS SYSTEM; CARDIOVASCULAR DISORDERS; GASTROINTESTINAL DISORDERS; DIABETES INSIPIDUS, AND SLEEP APNEA VERNALIS RESEARCH LIMITED (GB) 2002-04-30 US claimed
US-20110152272-A1 Treatment Of Incontinence PFIZER INC 2011-06-23 US disclosed
EP-2277513-A2 Treatment of incontinence with 5htc2 agonists Pfizer Inc. (US) 2011-01-26 EP disclosed
CN-1780612-B Treatment of incontinence with 5HT2C agonists. PFIZER 2010-12-01 CN disclosed
US-20080146583-A1 Treatment of Incontinence PFIZER INC 2008-06-19 US disclosed
CN-1780612-A Treatment of incontinence with 5HT2C agonists. PFIZER (US) 2006-05-31 CN disclosed
EP-1620081-A2 TREATMENT OF INCONTINENCE WITH 5HTC2 AGONISTS Pfizer Limited (GB) 2006-02-01 EP disclosed
US-20040235856-A1 Treatment of incontinence PFIZER INC 2004-11-25 US disclosed
WO-2004096196-A2 TREATMENT OF INCONTINENCE WITH 5HTC2 AGONISTS PFIZER LIMITED (GB) 2004-11-11 WO disclosed
US-6380238-B1 FOR THERAPY OF DISORDERS OF THE CENTRAL NERVOUS SYSTEM; DAMAGE TO THE CENTRAL NERVOUS SYSTEM; CARDIOVASCULAR DISORDERS; GASTROINTESTINAL DISORDERS; DIABETES INSIPIDUS, AND SLEEP APNEA VERNALIS RESEARCH LIMITED (GB) 2002-04-30 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 (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-20040235856-A1 Treatment of incontinence HTR2C, HTR5A, ADRA2C ALDH1A1 527/4885MEN1 4045/4885KMT2A 2378/4885
US-20110152272-A1 Treatment Of Incontinence HTR2C, HTR5A, ADRA2C ALDH1A1 527/4885MEN1 4045/4885KMT2A 2378/4885
US-20080146583-A1 Treatment of Incontinence HTR2C, HTR5A, ADRA2C ALDH1A1 527/4885MEN1 4045/4885KMT2A 2378/4885

“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.