SCHEMBL12491809

SCHEMBL12491809

O=Cc1cc(C(=O)O)cc(C=O)c1O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ERN1 O75460 11/20 0.54
▸ CA12 O43570 3/20 0.52
▸ CA1 P00915 3/20 0.52
▸ CA2 P00918 3/20 0.52
▸ CA7 P43166 3/20 0.52
▸ CA9 Q16790 3/20 0.52
▸ CA14 Q9ULX7 3/20 0.52
▸ ALDH1A1 P00352 2/20 0.52
▸ MAPT P10636 2/20 0.52
▸ KDM4E B2RXH2 2/20 0.52
▸ CA3 P07451 2/20 0.52
▸ CA4 P22748 2/20 0.52
▸ CA6 P23280 2/20 0.52
▸ CA5A P35218 2/20 0.52
▸ CA5B Q9Y2D0 2/20 0.52
▸ LMNA P02545 1/20 0.52
▸ TP53 P04637 1/20 0.52
▸ SELL P14151 1/20 0.52
▸ HPGD P15428 1/20 0.52
▸ SELP P16109 1/20 0.52

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
SCHEMBL7669530 0.89 MAPT (0.64) ERN1CA12CA1CA2CA7
SCHEMBL5648278 0.86 ERN1 (0.50) ERN1CA12CA1CA2CA7
SCHEMBL31056230 0.86 TTR (0.67) ERN1CA12CA1CA2CA7
SCHEMBL29475526 0.86 ERN1 (0.66) ERN1CA12CA1CA2CA7
SCHEMBL22465969 0.86 ERN1 (0.66) ERN1CA12CA1CA2CA7
SCHEMBL25385602 0.86 TTR (0.67) ERN1CA12CA1CA2CA7
SCHEMBL30574966 0.86 TTR (0.67) ERN1CA12CA1CA2CA7
SCHEMBL25385966 0.81 GLRA3 (0.50) ERN1ALDH1A1MAPTKDM4ELMNA
SCHEMBL15813536 0.81 CA12 (0.70) ERN1CA12CA1CA2CA7
SCHEMBL14953740 0.81 CYP19A1 (0.49) ERN1CA12CA1CA2CA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11673100-B2 Systems and methods for integrated solar photodialysis THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-06-13 — — US disclosed
US-11673100-B2 Systems and methods for integrated solar photodialysis THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-06-13 — — US disclosed
US-11318424-B2 Light-driven ion-pumping membrane systems THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2022-05-03 — — US disclosed
US-20190217255-A1 SYSTEMS AND METHODS FOR INTEGRATED SOLAR PHOTODIALYSIS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2019-07-18 — — US disclosed
EP-2686385-B1 ACTIVATABLE FLUOROGENIC COMPOUNDS AND USES THEREOF AS NEAR INFRARED PROBES UNIV RAMOT (IL) 2019-01-16 — — EP disclosed
EP-2686385-B1 ACTIVATABLE FLUOROGENIC COMPOUNDS AND USES THEREOF AS NEAR INFRARED PROBES UNIV RAMOT (IL) 2019-01-16 — — EP disclosed
US-10071983-B2 Activatable fluorogenic compounds and uses thereof as near infrared probes RAMOT AT TEL-AVIV UNIVERSITY LTD. (IL) 2018-09-11 — — US disclosed
CN-108218803-A A kind of method of hexa-atomic imines cycle compound and the hexa-atomic imines cycle compound of one pot process 首都医科大学 2018-06-29 — — CN disclosed
US-20180065095-A1 LIGHT-DRIVEN ION-PUMPING MEMBRANE SYSTEMS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2018-03-08 — — US disclosed
US-20180065095-A1 LIGHT-DRIVEN ION-PUMPING MEMBRANE SYSTEMS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2018-03-08 — — US disclosed
US-20160229840-A1 ACTIVATABLE FLUOROGENIC COMPOUNDS AND USES THEREOF AS NEAR INFRARED PROBES RAMOT AT TEL-AVIV UNIVERSITY LTD. (IL) 2016-08-11 — — US disclosed
US-20160229840-A1 ACTIVATABLE FLUOROGENIC COMPOUNDS AND USES THEREOF AS NEAR INFRARED PROBES RAMOT AT TEL-AVIV UNIVERSITY LTD. (IL) 2016-08-11 — — US disclosed
US-20160229840-A1 ACTIVATABLE FLUOROGENIC COMPOUNDS AND USES THEREOF AS NEAR INFRARED PROBES RAMOT AT TEL-AVIV UNIVERSITY LTD. (IL) 2016-08-11 — — US disclosed
US-9341630-B2 Activatable fluorogenic compounds and uses thereof as near infrared probes RAMOT AT TEL-AVIV UNIVERSITY LTD. (IL) 2016-05-17 — — US disclosed
US-9341630-B2 Activatable fluorogenic compounds and uses thereof as near infrared probes RAMOT AT TEL-AVIV UNIVERSITY LTD. (IL) 2016-05-17 — — US disclosed
US-9341630-B2 Activatable fluorogenic compounds and uses thereof as near infrared probes RAMOT AT TEL-AVIV UNIVERSITY LTD. (IL) 2016-05-17 — — US disclosed
EP-2686385-A2 ACTIVATABLE FLUOROGENIC COMPOUNDS AND USES THEREOF AS NEAR INFRARED PROBES Ramot at Tel Aviv University, Ltd. (IL) 2014-01-22 — — EP disclosed
WO-2012123916-A2 ACTIVATABLE FLUOROGENIC COMPOUNDS AND USES THEREOF AS NEAR INFRARED PROBES RAMOT AT TEL-AVIV UNIVERSITY LTD. (IL) 2012-09-20 — — WO disclosed
WO-2012123916-A2 ACTIVATABLE FLUOROGENIC COMPOUNDS AND USES THEREOF AS NEAR INFRARED PROBES RAMOT AT TEL-AVIV UNIVERSITY LTD. (IL) 2012-09-20 — — 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-20160229840-A1 ACTIVATABLE FLUOROGENIC COMPOUNDS AND USES THEREOF AS NEAR INFRARED PROBES PAICS, NQO1, APEX1 ERN1 2602/4885CA12 516/4885CA1 296/4885
US-10071983-B2 Activatable fluorogenic compounds and uses thereof as near infrared probes PAICS, NQO1, APEX1 ERN1 2602/4885CA12 516/4885CA1 296/4885

“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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