SCHEMBL7968447

SCHEMBL7968447

Cc1ccc(OC[C@H]2CO2)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.66
TP53 P04637 3/20 0.66
TSHR P16473 3/20 0.66
MAPT P10636 3/20 0.66
HPGD P15428 2/20 0.66
MEN1 O00255 2/20 0.66
KMT2A Q03164 2/20 0.66
HIF1A Q16665 2/20 0.66
CYP1A2 P05177 1/20 0.66
PPARG P37231 1/20 0.66
TDP1 Q9NUW8 1/20 0.66
PKM P14618 2/20 0.61
LMNA P02545 2/20 0.61
GAA P10253 1/20 0.61
SMN1; SMN2 Q16637 4/20 0.58
CYP3A4 P08684 1/20 0.58
GLA P06280 1/20 0.55
PDK1 Q15118 1/20 0.51
RAB9A P51151 3/20 0.50
NPC1 O15118 2/20 0.50

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
SCHEMBL5067444 1.00 ALDH1A1 (0.66) ALDH1A1TP53TSHRMAPTHPGD
SCHEMBL187051 1.00 ALDH1A1 (0.66) ALDH1A1TP53TSHRMAPTHPGD
Ammonia Solution, Strong SCHEMBL11545942 0.98 ALDH1A1 (0.64) ALDH1A1TP53TSHRMAPTHPGD
SCHEMBL13383366 0.94 ALDH1A1 (0.60) ALDH1A1TP53TSHRMAPTHPGD
SCHEMBL13527949 0.94 ALDH1A1 (0.60) ALDH1A1TP53TSHRMAPTHPGD
SCHEMBL13330202 0.91 ALDH1A1 (0.57) ALDH1A1TP53TSHRMAPTHPGD
SCHEMBL14062637 0.91 ALDH1A1 (0.57) ALDH1A1TP53TSHRMAPTHPGD
SCHEMBL5966311 0.90 ALDH1A1 (0.55) ALDH1A1TP53TSHRMAPTHPGD
SCHEMBL17897424 0.90 ALDH1A1 (0.55) ALDH1A1TP53TSHRMAPTHPGD
SCHEMBL16640986 0.90 ALDH1A1 (0.55) ALDH1A1TP53TSHRMAPTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109609479-A A kind of Aspergillus usamii epoxide hydrolase mutant that enantioselectivity improves 江南大学 2019-04-12 CN claimed
CN-116790203-A Itaconic acid deep eutectic solvent and preparation method and application thereof 华南农业大学 2023-09-22 CN disclosed
CN-113214455-B Toughening type water-based epoxy curing agent and preparation method and application thereof 万华化学集团股份有限公司 2022-04-22 CN disclosed
CN-113214455-A Toughening type water-based epoxy curing agent and preparation method and application thereof 万华化学集团股份有限公司 2021-08-06 CN disclosed
CN-109609479-B Aspergillus usamii epoxide hydrolase mutant with improved enantioselectivity 江南大学 2021-07-27 CN disclosed
CN-109609479-A A kind of Aspergillus usamii epoxide hydrolase mutant that enantioselectivity improves 江南大学 2019-04-12 CN disclosed
US-9938222-B2 Cyclopropanecarboxylic acid GPR120 modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2018-04-10 US disclosed
US-20170253554-A1 CYCLOPROPANECARBOXYLIC ACID GPR120 MODULATORS BRISTOL MYERS SQUIBB CO (US) 2017-09-07 US disclosed
CN-104450641-A Epoxide hydrolase as well as encoding gene and application thereof UNIV EAST CHINA SCIENCE & TECH 2015-03-25 CN disclosed
US-6242450-B1 SUBSTITUTED PIPERIDINES ELI LILLY AND COMPANY 2001-06-05 US disclosed
WO-2000006082-A2 TREATMENT OF ANXIETY DISORDERS ELI LILLY AND COMPANY (US) 2000-02-10 WO disclosed
WO-2000006166-A1 5-HT1F ANTAGONISTS ELI LILLY AND COMPANY (US) 2000-02-10 WO disclosed
EP-0976746-A1 5-HT1F antagonists ELI LILLY AND COMPANY (US) 2000-02-02 EP disclosed
EP-0976747-A2 Use of 5HT-1F receptor antagonists for treating anxiety disorders ELI LILLY AND COMPANY (US) 2000-02-02 EP 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-20170253554-A1 CYCLOPROPANECARBOXYLIC ACID GPR120 MODULATORS GPR88, GPBAR1, GPR68 ALDH1A1 2321/4885TP53 4594/4885TSHR 991/4885

“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.