SCHEMBL2772131

SCHEMBL2772131

CCCCOc1cc(C(=O)O)cc(C(=O)OC)c1

nearest known ligand 0.67

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PLA2G2A P14555 1/20 0.67
▸ TP53 P04637 1/20 0.54
▸ TSHR P16473 1/20 0.54
▸ PLA2G4B P0C869 4/20 0.53
▸ MAPT P10636 2/20 0.51
▸ RARB P10826 4/20 0.50
▸ NR1H4 Q96RI1 2/20 0.50
▸ RAB9A P51151 1/20 0.50
▸ KMT2A Q03164 1/20 0.49
▸ ALPL P05186 1/20 0.48
▸ PLA2G4A P47712 1/20 0.48

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
SCHEMBL9402625 0.94 PLA2G2A (0.77) PLA2G2ATP53TSHRPLA2G4BRARB
SCHEMBL2771698 0.94 MAPT (0.58) PLA2G2ATP53TSHRMAPTRAB9A
SCHEMBL3858281 0.92 PLA2G2A (0.59) PLA2G2ATP53TSHRPLA2G4BMAPT
SCHEMBL3077835 0.90 PLA2G2A (0.80) PLA2G2ATP53TSHRPLA2G4BRARB
SCHEMBL17413301 0.89 PLA2G2A (0.63) PLA2G2ATP53TSHRPLA2G4BMAPT
SCHEMBL28627609 0.89 PLA2G2A (0.77) PLA2G2ATP53TSHRPLA2G4BRARB
SCHEMBL89430 0.88 PLA2G2A (0.54) PLA2G2APLA2G4BMAPTNR1H4RAB9A
SCHEMBL7089932 0.87 PLA2G2A (0.66) PLA2G2ATP53TSHRPLA2G4BMAPT
SCHEMBL9402623 0.87 PLA2G2A (0.66) PLA2G2ATP53TSHRPLA2G4BMAPT
SCHEMBL1822124 0.87 PLA2G2A (0.66) PLA2G2ATP53TSHRPLA2G4BMAPT

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
CN-109485573-B Aromatic dicarboxylic acid ionic liquid and preparation method and application thereof 宝鸡文理学院 2021-04-30 — — CN disclosed
CN-102958912-B Benzohydrol derivatives, a preparation process and pharmaceutical use thereof SHANGHAI HENGRUI PHARM CO LTD 2015-01-14 — — CN disclosed
CN-102958912-A Benzohydrol derivatives, a preparation process and pharmaceutical use thereof SHANGHAI HENGRUI PHARM CO LTD 2013-03-06 — — CN disclosed
CN-102372653-A Diphenyl methanol derivative, preparation method thereof and application of diphenyl methanol derivative in medicine JIANGSU HENGRUI MEDICINE CO 2012-03-14 — — CN disclosed
WO-2012019428-A1 BENZOHYDROL DERIVATIVES, A PREPARATION PROCESS AND PHARMACEUTICAL USE THEREOF 上海恒瑞医药有限公司 (CN) 2012-02-16 — — WO disclosed
US-7846960-B2 FXR agonists ELI LILLY AND COMPANY (US) 2010-12-07 — — US disclosed
EP-2029547-B1 FXR AGONISTS LILLY CO ELI (US) 2010-04-28 — — EP disclosed
US-20090270460-A1 FXR AGONISTS JPMORGAN CHASE BANK, N.A., AS SUCCESSOR COLLATERAL AGENT 2009-10-29 — — US disclosed
EP-2029547-A1 FXR AGONISTS ELI LILLY AND COMPANY (US) 2009-03-04 — — EP disclosed
WO-2007140183-A1 FXR AGONISTS ELI LILLY AND COMPANY (US) 2007-12-06 — — 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-20090270460-A1 FXR AGONISTS NR1H4, SLC10A1, GPBAR1 PLA2G2A 993/4885TP53 4727/4885TSHR 480/4885

“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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