SCHEMBL7606025

SCHEMBL7606025

COc1cc2c(c(C)c1C)C(=O)CC2c1c[nH]cn1

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.35
ABCB1 P08183 2/20 0.33
ABCG2 Q9UNQ0 2/20 0.33
CYP19A1 P11511 1/20 0.32
TSHR P16473 3/20 0.32
GAA P10253 1/20 0.32
KMT2A Q03164 1/20 0.32
LMNA P02545 2/20 0.32
ACHE P22303 2/20 0.32
TP53 P04637 2/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
MAP2K3 P46734 1/20 0.31
MAPK1 P28482 2/20 0.31
ALOX15 P16050 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL7605296 0.82 ESR1 (0.32) ABCG2KMT2AL3MBTL1
SCHEMBL7607044 0.82 ABCB1 (0.33) ABCB1ABCG2CYP19A1ACHEMAP2K3
SCHEMBL7604210 0.78 ADRA1A (0.38) KMT2ALMNA
Hydrochloric Acid SCHEMBL7604517 0.77 ADRA1A (0.37) KMT2ALMNA
SCHEMBL7606650 0.74
SCHEMBL8865242 0.68 CHRNA7 (0.41) ABCB1TSHRKMT2A
SCHEMBL8866074 0.65 ADRA1A (0.45) KDM4E
SCHEMBL7607557 0.63 ACHE (0.40) KDM4EABCB1ABCG2LMNAACHE
SCHEMBL8865462 0.63 PARP1 (0.43) KDM4E
SCHEMBL7866083 0.63 PARP1 (0.41) ACHESMN1; SMN2MAP2K3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6479530-B2 SUBSTITUTED 4(5)-(1-INDANYL,-INDANYLMETHYL, INDANYLMETHYLEN), 4(5)-(1-(1,2,3,4-TETRAHYDRONAPHTHYL, -NAPHTHYLMETHYL AND NAPHTHYLMETHYLEN)IMIDAZOLES; HYPOTENSIVE, ISCHEMIC AND ANXIOLYTIC AGENTS; NERVOUS AND MUSCULAR SYSTEM DISORDERS ORION CORPORATION (FI) 2002-11-12 US disclosed
US-20020007074-A1 Imidazole derivatives having affinity for alpha2 receptors KARJALAINEN ARTO (FI) 2002-01-17 US disclosed
US-6313311-B1 ADRENERGIC STIMULANTS FOR POTENTIATING ANESTHETICS PRIOR TO SURGERY; HYPOTENSIVE AGENTS, ANALGESICS, ANTIISCHEMIC AGENTS; NERVOUS SYSTEM AND PSYCHOLOGICAL DISORDERS ORION CORPORATION (FI) 2001-11-06 US disclosed
EP-0888309-A1 IMIDAZOLE DERIVATIVES HAVING AFFINITY FOR ALPHA2 RECEPTORS ACTIVITY ORION CORPORATION (FI) 1999-01-07 EP disclosed
WO-1997012874-A1 IMIDAZOLE DERIVATIVES HAVING AFFINITY FOR ALPHA2 RECEPTORS ACTIVITY Orion-Yhtymä Oy (FI) 1997-04-10 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 (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-20020007074-A1 Imidazole derivatives having affinity for alpha2 receptors CHRM1, CHRNA1, CNR1 KDM4E 3475/4885ABCB1 2963/4885ABCG2 1990/4885

“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.