SCHEMBL744007

SCHEMBL744007

O=C1C=CC(c2ccccc2)(c2ccccc2)CC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.44
CYP2C9 P11712 1/20 0.44
KMT2A Q03164 1/20 0.44
ALDH1A1 P00352 1/20 0.40
AKR1C1 Q04828 2/20 0.36
AKR1C3 P42330 1/20 0.36
AKR1C2 P52895 1/20 0.36
OPRM1 P35372 2/20 0.33
OPRK1 P41145 1/20 0.33
OPRL1 P41146 1/20 0.33
HSD11B1 P28845 1/20 0.33
PNMT P11086 1/20 0.32
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
TAAR1 Q96RJ0 1/20 0.32
CHRM2 P08172 1/20 0.32
CHRM4 P08173 1/20 0.32
MAPK1 P28482 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
DAO P14920 1/20 0.32

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
SCHEMBL5875966 0.90 CYP2C9 (0.37) MEN1CYP2C9KMT2AALDH1A1OPRM1
SCHEMBL14260462 0.86 OPRM1 (0.49) KMT2AALDH1A1OPRM1OPRK1OPRL1
SCHEMBL14531844 0.81 PDE4B (0.48) MEN1KMT2AALDH1A1MAOASMN1; SMN2
SCHEMBL14260464 0.81 PDE4B (0.48) MEN1KMT2AALDH1A1MAOASMN1; SMN2
SCHEMBL5876222 0.81 DAO (0.35) MEN1KMT2AHSD11B1MAOAMAOB
SCHEMBL8992285 0.79 CYP2C9 (0.38) MEN1CYP2C9KMT2AALDH1A1AKR1C1
SCHEMBL9729483 0.79 HDAC4 (0.40) OPRM1OPRK1OPRL1HSD11B1
SCHEMBL9729634 0.79 KDM1A (0.40) OPRM1OPRK1OPRL1HSD11B1
SCHEMBL9729263 0.79 SLC6A4 (0.40) MEN1KMT2AHSD11B1
SCHEMBL8873535 0.77 MEN1 (0.41) MEN1CYP2C9KMT2AALDH1A1AKR1C1

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 107 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10106562-B2 Process for manufacture of gadofosveset trisodium monohydrate LANTHEUS MEDICAL IMAGING, INC. (US) 2018-10-23 US claimed
US-20160016979-A1 PROCESS FOR MANUFACTURE OF GADOFOSVESET TRISODIUM MONOHYDRATE CITIZENS BANK, N.A. 2016-01-21 US claimed
EP-2970140-A1 PROCESS FOR MANUFACTURE OF GADOFOSVESET TRISODIUM MONOHYDRATE Lantheus Medical Imaging, Inc. (US) 2016-01-20 EP claimed
WO-2014160039-A1 PROCESS FOR MANUFACTURE OF GADOFOSVESET TRISODIUM MONOHYDRATE LANTHEUS MEDICAL IMAGING, INC. (US) 2014-10-02 WO claimed
US-6461417-B1 Ink compositions XEROX CORPORATION 2002-10-08 US claimed
US-6117223-A Hot melt inks containing polyketones XEROX CORPORATION (US) 2000-09-12 US claimed
EP-3137440-B1 BONDING AGENTS FOR NITROGEN-CONTAINING OXIDIZERS RAYTHEON CO (US) 2021-01-20 EP disclosed
US-10227267-B2 Bonding agents for nitrogen-containing oxidizers RAYTHEON COMPANY (US) 2019-03-12 US disclosed
US-10106562-B2 Process for manufacture of gadofosveset trisodium monohydrate LANTHEUS MEDICAL IMAGING, INC. (US) 2018-10-23 US disclosed
EP-3137438-B1 METHODS TO DESENSITIZE HYDRAZINIUM NITROFORMATE (HNF) RAYTHEON CO (US) 2018-09-12 EP disclosed
US-20170173107-A1 Compstatin Analogs With Improved Potency and Pharmacokinetic Properties THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2017-06-22 US disclosed
US-20170173107-A1 Compstatin Analogs With Improved Potency and Pharmacokinetic Properties THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2017-06-22 US disclosed
US-20170173107-A1 Compstatin Analogs With Improved Potency and Pharmacokinetic Properties THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2017-06-22 US disclosed
EP-0831799-A1 COMPOUNDS ACTIVE AT A NOVEL SITE ON RECEPTOR-OPERATED CALCIUM CHANNELS USEFUL FOR TREATMENT OF NEUROLOGICAL DISORDERS NPS PHARMACEUTICALS, INC. (US) 1998-04-01 EP disclosed
WO-1997046511-A1 COUMPOUNDS ACTIVE AT A NOVEL SITE ON RECEPTOR-OPERATED CALCIUM CHANNELS USEFUL FOR TREATMENT OF NEUROLOGICAL DISORDERS AND DISEASES NPS PHARMACEUTICALS, INC. (US) 1997-12-11 WO disclosed
WO-1996040097-A1 COMPOUNDS ACTIVE AT A NOVEL SITE ON RECEPTOR-OPERATED CALCIUM CHANNELS USEFUL FOR TREATMENT OF NEUROLOGICAL DISORDERS NPS PHARMACEUTICALS, INC. (US) 1996-12-19 WO disclosed
US-5508433-A Derivatives of perhydroisoindole and preparation thereof RHONE-POULENC RORER S.A. (FR) 1996-04-16 US disclosed
US-5451601-A Perhydroisoindole derivatives and pharmaceutical compositions containing them RHONE-POULENC RORER S.A. (FR) 1995-09-19 US disclosed
US-5112988-A ISOINDOLONE DERIVATIVES RHONE-POULENC SANTE (FR) 1992-05-12 US disclosed
US-5102667-A Antiallergens, antiinflammatory agents, nervous system disorders, immunology, psychological disorders RHONE-POULENC SANTE (FR) 1992-04-07 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-20160016979-A1 PROCESS FOR MANUFACTURE OF GADOFOSVESET TRISODIUM MONOHYDRATE SLC6A13, SLC6A11, MPST MEN1 268/4885CYP2C9 1176/4885KMT2A 2904/4885
US-20170173107-A1 Compstatin Analogs With Improved Potency and Pharmacokinetic Properties CFB, C3AR1, C9 MEN1 204/4885CYP2C9 4213/4885KMT2A 4462/4885
US-10106562-B2 Process for manufacture of gadofosveset trisodium monohydrate SLC6A13, SLC6A11, MPST MEN1 268/4885CYP2C9 1176/4885KMT2A 2904/4885

“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.