SCHEMBL7034295

SCHEMBL7034295

CC(C)(C)c1ccc(CCC(O)c2c[nH]cn2)cc1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.36
SIGMAR1 Q99720 5/20 0.35
GPR84 Q9NQS5 1/20 0.35
GRIA4 P48058 1/20 0.35
SLC13A5 Q86YT5 2/20 0.34
ESRRG P62508 2/20 0.34
DAO P14920 1/20 0.34
RECQL P46063 1/20 0.34
ESRRB O95718 1/20 0.33

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
SCHEMBL10738378 0.85 CYP1A2 (0.34) GPR84DAO
SCHEMBL10737487 0.85 TAAR1 (0.34) GPR84
SCHEMBL10739591 0.82 CYP2C19 (0.41) KCNH2DAO
SCHEMBL10745565 0.75 TAAR1 (0.41) GPR84DAO
SCHEMBL14839515 0.75 ADRB2 (0.44) KCNH2GRIA4SLC13A5ESRRGDAO
SCHEMBL10737688 0.74 TAAR1 (0.38) GPR84DAO
SCHEMBL9121119 0.74 FAAH (0.45)
SCHEMBL6944501 0.73 CYP11B1 (0.30)
SCHEMBL10745306 0.72 ACP1 (0.34)
SCHEMBL10740003 0.72 ESR1 (0.32)

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-0888309-B1 IMIDAZOLE DERIVATIVES HAVING AFFINITY FOR ALPHA2 RECEPTORS ACTIVITY ORION CORP (FI) 2003-03-19 EP disclosed
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
CN-1068592-C Imidazole derivatives having affinity for alpha 2 receptors activity ORION YHTYMAE OY (FI) 2001-07-18 CN disclosed
EP-0888309-A1 IMIDAZOLE DERIVATIVES HAVING AFFINITY FOR ALPHA2 RECEPTORS ACTIVITY ORION CORPORATION (FI) 1999-01-07 EP disclosed
CN-1198741-A Imidazole derivatives having affinity for alpha 2 receptor activity ORION YHTYMAE OY (FI) 1998-11-11 CN 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 KCNH2 78/4885SIGMAR1 75/4885GPR84 530/4885

“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.