SCHEMBL5888769

SCHEMBL5888769

Fc1cccc(C=C2CCN(Cc3ccccc3)CC2)c1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
HRH3 Q9Y5N1 1/20 0.49
KMT2A Q03164 3/20 0.48
MEN1 O00255 2/20 0.48
SIGMAR1 Q99720 4/20 0.46
CYP2D6 P10635 1/20 0.44
MAPK1 P28482 1/20 0.44
GAA P10253 1/20 0.43
FAAH O00519 1/20 0.43
ACHE P22303 2/20 0.43
BACE1 P56817 2/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
POLB P06746 1/20 0.43
HSD17B10 Q99714 1/20 0.43

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
SCHEMBL11880520 0.95 ALDH1A1 (0.52) ALDH1A1SMN1; SMN2HRH3KMT2AMEN1
SCHEMBL2257602 0.85 SIGMAR1 (0.59) ALDH1A1HRH3SIGMAR1GAAACHE
SCHEMBL5817187 0.84 ACHE (0.56) SMN1; SMN2HRH3SIGMAR1ACHEBACE1
SCHEMBL17155418 0.83 HRH3 (0.49) HRH3SIGMAR1GAAFAAHACHE
SCHEMBL17153150 0.78 MAPK1 (0.65) ALDH1A1SMN1; SMN2KMT2AMEN1SIGMAR1
SCHEMBL16225922 0.77 ALDH1A1 (0.74) ALDH1A1SMN1; SMN2KMT2AMEN1SIGMAR1
SCHEMBL14013779 0.75 HRH3 (0.52) ALDH1A1HRH3KMT2AMEN1SIGMAR1
SCHEMBL13739501 0.75 HDAC2 (0.55) SMN1; SMN2KMT2AMEN1SIGMAR1NPC1
SCHEMBL5547852 0.75 LMNA (0.61) ALDH1A1HRH3SIGMAR1MAPK1GAA
SCHEMBL10407610 0.75 EP300 (0.58) KMT2AMEN1SIGMAR1ACHEBACE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2916833-A1 METHODS OF TREATING LIVER DISEASES Zafgen, Inc. (US) 2015-09-16 EP disclosed
WO-2014071368-A1 METHODS OF TREATING LIVER DISEASES ZAFGEN, INC. (US) 2014-05-08 WO disclosed
US-7019016-B2 Therapy of sensorineural hearing loss in a mammal by administering NR2B subunit selective N-methyl-D-aspartate (NMDA) NR2B subtype receptor antagonist PFIZER INC (US) 2006-03-28 US disclosed
US-20030144319-A1 Subtype-selective NMDA receptor ligands and the use thereof BIGGE CHRISTOPHER F (US) 2003-07-31 US disclosed
US-6534522-B2 E.g.,N-((4-amino-3-nitrophenoxy)ethyl)-1,2,3,4-tetrahydro -isoquinoline; stroke; antiischemic agents; CNS trauma, hyperglycemic agents; surgery; neurodegenerative diseases including Alzheimer's disease, amyotrophic lateral sclerosis WARNER-LAMBERT COMPANY 2003-03-18 US disclosed
US-20010051633-A1 Subtype-selective NMDA receptor ligands and the use thereof BIGGE CHRISTOPHER F (US) 2001-12-13 US disclosed
US-6218404-B1 THERAPY AND PROPHYLAXIS OF NEURONAL LOSS ASSOCIATED WITH STROKE, ISCHEMIA, CNS TRAUMA, HYPOGLYCEMIA AND SURGERY, NEURO-DEGENERATIVE DISEASES INCLUDING ALZHEIMER'S DISEASE, AMYOTROPHIC LATERAL SCLEROSIS, HUNTINGTON'S DISEASE WARNER-LAMBERT CO. 2001-04-17 US disclosed
WO-1997023458-A1 SUBTYPE-SELECTIVE NMDA RECEPTOR LIGANDS AND THE USE THEREOF WARNER-LAMBERT COMPANY (US) 1997-07-03 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 (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-20030144319-A1 Subtype-selective NMDA receptor ligands and the use thereof OPRK1, OPRD1, OPRL1 ALDH1A1 2672/4885SMN1; SMN2 274/4885HRH3 1326/4885
US-20010051633-A1 Subtype-selective NMDA receptor ligands and the use thereof OPRK1, OPRD1, OPRL1 ALDH1A1 2672/4885SMN1; SMN2 274/4885HRH3 1326/4885

“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.