SCHEMBL8625311

SCHEMBL8625311

Oc1ccccc1C1C=CCC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.42
KMT2A Q03164 4/20 0.42
HTR2A P28223 1/20 0.37
HTR2C P28335 1/20 0.37
HTR2B P41595 1/20 0.37
MAPT P10636 3/20 0.36
RAB9A P51151 3/20 0.36
ALDH1A1 P00352 2/20 0.36
HPGD P15428 2/20 0.36
ALOX15 P16050 2/20 0.36
HSD17B10 Q99714 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
GAA P10253 2/20 0.36
CYP1A2 P05177 2/20 0.36
CYP2D6 P10635 2/20 0.36
CYP2C9 P11712 2/20 0.36
CYP2C19 P33261 2/20 0.36
APP P05067 1/20 0.36
TSHR P16473 1/20 0.36
ALOX12 P18054 1/20 0.36

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
SCHEMBL30631565 0.89 MEN1 (0.43) MEN1KMT2AHTR2AHTR2CHTR2B
SCHEMBL4269854 0.89 MEN1 (0.43) MEN1KMT2AHTR2AHTR2CHTR2B
SCHEMBL6755825 0.82 TRPA1 (0.39) MEN1KMT2AHTR2CMAPTNPSR1
SCHEMBL6755917 0.78 IDO1 (0.45) MEN1KMT2AMAPTHPGDALOX15
SCHEMBL27768225 0.78 CHRNB2 (0.34) MEN1KMT2AMAPTRAB9AALDH1A1
SCHEMBL14283801 0.77 ESR1 (0.36) HTR2AHTR2CHTR2BALDH1A1ALOX15
SCHEMBL28015761 0.77 MEN1 (0.41) MEN1KMT2AHTR2AHTR2CHTR2B
SCHEMBL13953886 0.76 KDM1A (0.42) MEN1KMT2AHTR2CHTR2BGAA
SCHEMBL16755274 0.76 ALDH1A1 (0.42) MEN1KMT2AHTR2AHTR2CHTR2B
SCHEMBL511920 0.76 DPP4 (0.42) MEN1KMT2AHTR2AHTR2CHTR2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190048123-A1 METHOD OF PRODUCING FIVE-CARBON RING-CONTAINING COMPOUND AND FIVE-CARBON RING DERIVATIVE-CONTAINING POLYURETHANE, AND FIVE-CARBON RING DERIVATIVE-CONTAINING POLYURETHANE NATIONAL CHUNG SHAN INSTITUTE OF SCIENCE AND TECHNOLOGY (TW) 2019-02-14 US claimed
US-10654965-B2 Method of producing five-carbon ring-containing compound and five-carbon ring derivative-containing polyurethane, and five-carbon ring derivative-containing polyurethane NATIONAL CHUNG SHAN INSTITUTE OF SCIENCE AND TECHNOLOGY (TW) 2020-05-19 US disclosed
US-20190048123-A1 METHOD OF PRODUCING FIVE-CARBON RING-CONTAINING COMPOUND AND FIVE-CARBON RING DERIVATIVE-CONTAINING POLYURETHANE, AND FIVE-CARBON RING DERIVATIVE-CONTAINING POLYURETHANE NATIONAL CHUNG SHAN INSTITUTE OF SCIENCE AND TECHNOLOGY (TW) 2019-02-14 US disclosed
EP-2793577-B1 ANTIMICROBIAL METHOD AND COMPOSITION UNILEVER NV (NL) 2017-04-12 EP disclosed
EP-0595770-B1 Novel dithiophosphates as antiwear additives CIBA GEIGY AG (CH) 1998-01-14 EP disclosed
US-5328621-A Lubricants for internal combustion engines CIBA-GEIGY CORPORATION (US) 1994-07-12 US disclosed
EP-0595770-A1 Novel dithiophosphates as antiwear additives CIBA-GEIGY AG (CH) 1994-05-04 EP disclosed
US-4970238-A Adrenergic blocking agents, cardiovascular disorders Louis, John William (AU) 1990-11-13 US disclosed
US-4816604-A CARDIOVASCULAR DISORDERS Louis, William J. (AU) 1989-03-28 US disclosed
WO-1982000141-A1 3-AMINO-PROPOXY-PHENYL DERIVATIVES,PREPARATION THEREOF AND DRUGS CONTAINING THEM SANDOZ AG (CH) 1982-01-21 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 (2 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-20190048123-A1 METHOD OF PRODUCING FIVE-CARBON RING-CONTAINING COMPOUND AND FIVE-CARBON RING DERIVATIVE-CONTAINING POLYURETHANE, AND FIVE-CARBON RING DERIVATIVE-CONTAINING POLYURETHANE UROD, DCUN1D5, DCTD MEN1 3148/4885KMT2A 3119/4885HTR2A 3249/4885
US-10654965-B2 Method of producing five-carbon ring-containing compound and five-carbon ring derivative-containing polyurethane, and five-carbon ring derivative-containing polyurethane UROD, DCUN1D5, DCTD MEN1 3148/4885KMT2A 3119/4885HTR2A 3249/4885

“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.