SCHEMBL12403165

SCHEMBL12403165

c1ccc2nc(-c3ccc4[nH]cnc4c3)ccc2c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 13/20 0.50
▸ NPC1 O15118 12/20 0.50
▸ KDM4E B2RXH2 10/20 0.50
▸ ALDH1A1 P00352 9/20 0.50
▸ SMN1; SMN2 Q16637 8/20 0.50
▸ AR P10275 4/20 0.50
▸ MEN1 O00255 3/20 0.50
▸ KMT2A Q03164 3/20 0.50
▸ MAPT P10636 5/20 0.49
▸ NFKB1 P19838 2/20 0.49
▸ NFKB2 Q00653 2/20 0.49
▸ RELA Q04206 2/20 0.49
▸ L3MBTL1 Q9Y468 2/20 0.49
▸ LMNA P02545 1/20 0.49
▸ TP53 P04637 4/20 0.49
▸ HPGD P15428 4/20 0.49
▸ HSD17B10 Q99714 4/20 0.49
▸ CYP3A4 P08684 3/20 0.49
▸ PKM P14618 3/20 0.49
▸ GMNN O75496 1/20 0.49

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
SCHEMBL6008269 0.77 MAPT (0.50) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL31143361 0.77 MAPT (0.50) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL7914859 0.77 NPC1 (0.58) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL30938000 0.77 NPC1 (0.58) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL15190605 0.77 ALDH1A1 (0.39) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL2457365 0.76 QPCT (0.50) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL484215 0.76 NPC1 (0.57) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL240431 0.76 NPC1 (0.63) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL34467584 0.76 NPC1 (0.63) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL9562898 0.76 NPC1 (0.45) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2411057-B1 IMAGING AGENTS FOR DETECTING NEUROLOGICAL DISORDERS LILLY CO ELI (US) 2020-05-06 — — EP disclosed
US-20130302248-A1 Imaging Agents for Detecting Neurological Disorders LILLY CO ELI (US) 2013-11-14 — — US disclosed
US-20130302248-A1 Imaging Agents for Detecting Neurological Disorders LILLY CO ELI (US) 2013-11-14 — — US disclosed
US-8491869-B2 Imaging agents for detecting neurological disorders ELI LILLY AND COMPANY (US) 2013-07-23 — — US disclosed
US-20110182812-A1 Imaging Agents for Detecting Neurological Disorders SIEMENS MEDICAL SOLUTIONS USA, INC. (US) 2011-07-28 — — US disclosed
US-20110182812-A1 Imaging Agents for Detecting Neurological Disorders SIEMENS MEDICAL SOLUTIONS USA, INC. (US) 2011-07-28 — — US disclosed
WO-2010111303-A2 IMAGING AGENTS FOR DETECTING NEUROLOGICAL DISORDERS SIEMENS MEDICAL SOLUTIONS USA, INC. (US) 2010-09-30 — — WO disclosed
US-20100239496-A1 Imaging agents for detecting neurological disorders SIEMENS MEDICAL SOLUTIONS USA, INC. (US) 2010-09-23 — — US disclosed
US-20100239496-A1 Imaging agents for detecting neurological disorders SIEMENS MEDICAL SOLUTIONS USA, INC. (US) 2010-09-23 — — 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-20130302248-A1 Imaging Agents for Detecting Neurological Disorders MAPT, APP, PSEN1 RAB9A 1055/4885NPC1 68/4885KDM4E 4835/4885
US-20110182812-A1 Imaging Agents for Detecting Neurological Disorders MAPT, APP, PSEN1 RAB9A 1434/4885NPC1 143/4885KDM4E 4835/4885
US-20100239496-A1 Imaging agents for detecting neurological disorders MAPT, APP, PSEN1 RAB9A 1055/4885NPC1 68/4885KDM4E 4835/4885

“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.

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