SCHEMBL7239123

SCHEMBL7239123

O=C(O)CC(=O)CCCc1ccccc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 7/20 0.70
HDAC2 Q92769 4/20 0.70
HDAC3 O15379 3/20 0.70
HDAC8 Q9BY41 3/20 0.70
HDAC6 Q9UBN7 3/20 0.70
HDAC5 Q9UQL6 3/20 0.70
HDAC4 P56524 2/20 0.70
HDAC7 Q8WUI4 2/20 0.70
HDAC10 Q969S8 2/20 0.70
HDAC11 Q96DB2 2/20 0.70
HDAC9 Q9UKV0 2/20 0.70
MAPK1 P28482 1/20 0.70
ADRA1A P35348 1/20 0.70
SLC6A3 Q01959 1/20 0.70
SMN1; SMN2 Q16637 1/20 0.70
MMP12 P39900 1/20 0.62
MAPT P10636 1/20 0.60
RXFP1 Q9HBX9 1/20 0.60
NPC1 O15118 1/20 0.58
CASP3 P42574 1/20 0.58

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
SCHEMBL11295192 0.92 MAPT (0.72) HDAC1HDAC2HDAC3HDAC8HDAC6
SCHEMBL9404033 0.92 HDAC1 (0.69) HDAC1HDAC2HDAC3HDAC8HDAC6
SCHEMBL1532408 0.88 MMP12 (0.79) HDAC1HDAC2HDAC3HDAC8HDAC6
SCHEMBL5674267 0.87 HDAC1 (0.75) HDAC1HDAC2HDAC3HDAC8HDAC6
SCHEMBL11588924 0.86 MAPT (0.68) HDAC1HDAC2HDAC3HDAC8HDAC6
SCHEMBL10758583 0.85 MMP12 (0.54) HDAC1HDAC2HDAC3HDAC8HDAC6
SCHEMBL5027337 0.85 HDAC1 (0.60) HDAC1HDAC2HDAC3HDAC8HDAC6
SCHEMBL10755024 0.85 TRPV1 (0.55) HDAC1HDAC2HDAC3HDAC8HDAC6
SCHEMBL10753679 0.84 FFAR1 (0.68) TDP1FFAR1ALOX5
SCHEMBL7279036 0.84 HDAC1 (0.77) HDAC1HDAC2HDAC3HDAC8HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2308829-B1 A PROCESS FOR PREPARING R-BETA-AMINO PHENYLBUTYRIC ACID DERIVATIVES JIANGSU HENGRUI MEDICINE CO (CN) 2017-06-14 EP claimed
CN-101952275-B Modulators for amyloid protein beta HOFFMANN LA ROCHE 2014-06-18 CN disclosed
CN-101952275-A Modulators for amyloid beta HOFFMANN LA ROCHE 2011-01-19 CN disclosed
US-6608086-B2 Selective adrenergic receptor alpha 1C antagonists without significant calcium channel activity; treating benign prostatic hyperplasia, intraocular pressure and inhibiting cholesterol synthesis SYNAPTIC PHARMACEUTICAL CORPORATION 2003-08-19 US disclosed
US-20020193599-A1 Dihydropyridines and new uses thereof SYNAPTIC PHARMACEUTICAL CORPORATION 2002-12-19 US disclosed
US-6310076-B1 TREATING BENIGN PROSTATIC HYPERPLASIA, LOWERING INTRAOCULAR PRESSURE, INHIBITING CHOLESTEROL SYNTHESIS, TREATING DISEASES MEDIATED BY ALPHA-1 RECEPTORS SYNAPTIC PHARMACEUTICAL CORPORATION 2001-10-30 US disclosed
US-6211198-B1 BENIGN PROSTATE HYPERPLASIA; INTRAOCULAR PRESSURE; HYPOTENSIVE AGENTS SYNAPTIC PHARMACEUTICAL CORPORATION 2001-04-03 US disclosed
US-5767131-A TREATMENT OF BENIGN PROSTATIC HYPERPLASIA, INHIBITION OF CHOLESTEROL SYNTHESIS, LOWERING OF INTRAOCULAR PRESSURE; ALPHA-ADRENERGIC RECEPTOR DISEASES SYNAPTIC PHARMACEUTICAL CORPORATION (US) 1998-06-16 US disclosed
WO-1994022829-A2 DIHYDROPYRIDINES AND NEW USES THEREOF SYNAPTIC PHARMACEUTICAL CORPORATION (US) 1994-10-13 WO disclosed
US-4179564-A 1,5,6,11-Tetrahydro[5,6]cyclohepta[1,2-b]pyrazolo[4,3-e]pyridine derivatives E. R. SQUIBB & SONS, INC. (US) 1979-12-18 US disclosed
US-4128717-A Derivatives of 5,6-dihydrobenzo[5,6]cyclohepta[1,2-B]pyrazolo-[4,3-E]pyridin-11 (1H)-ones and 11 (1H)-imines E. R. SQUIBB & SONS, INC. (US) 1978-12-05 US disclosed
US-4111940-A ANTIINFLAMMATORY, PSYCHOTROPIC E. R. SQUIBB & SONS, INC. (US) 1978-09-05 US disclosed
US-4062858-A Derivatives of 5,6-dihydrobenzo[5,6]cyclohepta[1,2-b]pyrazolo[4,3-e]pyridin-11(1H)-ones and 11(1H)-imines E. R. SQUIBB & SONS, INC. (US) 1977-12-13 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 (1 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-20020193599-A1 Dihydropyridines and new uses thereof BPHL, BCKDK, DHCR7 HDAC1 1499/4885HDAC2 981/4885HDAC3 267/4885

“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.