SCHEMBL6494629

SCHEMBL6494629

Cn1nc(-c2ccccn2)cc1C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.51
KDM6B O15054 1/20 0.51
KDM4A O75164 1/20 0.51
KDM5C P41229 1/20 0.51
KDM4C Q9H3R0 1/20 0.51
KDM2A Q9Y2K7 1/20 0.51
KDM3A Q9Y4C1 1/20 0.51
PIN1 Q13526 1/20 0.51
CA12 O43570 1/20 0.49
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
CA9 Q16790 1/20 0.49
PTPN1 P18031 1/20 0.48
GRN P28799 1/20 0.45
SORT1 Q99523 1/20 0.45
GRM5 P41594 1/20 0.44
LMNA P02545 2/20 0.44
CYP1A2 P05177 1/20 0.44
POLB P06746 1/20 0.44
CCR1 P32246 1/20 0.44

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
SCHEMBL22619824 0.98 KDM4E (0.50) KDM4EKDM6BKDM4AKDM5CKDM4C
SCHEMBL15048551 0.86 KLK3 (0.48) KDM4EKDM6BKDM4AKDM5CKDM4C
Lithium Ion SCHEMBL28524144 0.85 P4HTM (0.47) KDM4EKDM6BKDM4AKDM5CKDM4C
SCHEMBL26659258 0.82 KDM4E (0.49) KDM4EKDM6BKDM4AKDM5CKDM4C
SCHEMBL25434077 0.81 KDM4E (0.48) KDM4EKDM6BKDM4AKDM5CKDM4C
SCHEMBL31039814 0.80 ALDH1A1 (0.57) KDM4ECA12CA1CA2CA9
SCHEMBL22619770 0.80 ALDH1A1 (0.57) KDM4ECA12CA1CA2CA9
SCHEMBL2792109 0.80 PHGDH (0.61) PIN1CA12CA1CA2CA9
SCHEMBL1458827 0.77 KDM4E (0.50) KDM4EKDM6BKDM4AKDM5CKDM4C
SCHEMBL3436593 0.75 CA12 (0.55) KDM4ECA12CA1CA2CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119060036-A ATF6 inhibitors and uses thereof 阿尔托斯实验室公司 2024-12-03 CN disclosed
CN-112313224-B ATF6 inhibitors and uses thereof 阿尔托斯实验室公司 2024-08-13 CN disclosed
US-20240124434-A1 ATF6 INHIBITORS AND USES THEREOF ALTOS LABS, INC. 2024-04-18 US disclosed
US-20210221803-A1 ATF6 INHIBITORS AND USES THEREOF ALTOS LABS, INC. 2021-07-22 US disclosed
EP-3774782-A2 ATF6 INHIBITORS AND USES THEREOF Black Belt TX Ltd (GB) 2021-02-17 EP disclosed
CN-112313224-A ATF6 inhibitors and uses thereof 黑带医疗有限责任公司 2021-02-02 CN disclosed
US-10829485-B2 ATF6 inhibitors and uses thereof BLACK BELT TX LTD (GB) 2020-11-10 US disclosed
CN-1228327-C Carboxylic acid derivatives and drugs containing the same EISAI CO LTD (JP) 2005-11-23 CN disclosed
US-6884821-B1 Carboxylic acid derivatives and drugs containing the same EISAI CO., LTD. (JP) 2005-04-26 US disclosed
CN-1377336-A Carboxylic acid derivatives and drugs containing the same EISAI CO LTD (JP) 2002-10-30 CN disclosed
EP-1216980-A1 CARBOXYLIC ACID DERIVATIVES AND DRUGS CONTAINING THE SAME Eisai Co., Ltd. (JP) 2002-06-26 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 (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-20240124434-A1 ATF6 INHIBITORS AND USES THEREOF ATF4, XBP1, ATF1 KDM4E 4305/4885KDM6B 4027/4885KDM4A 4328/4885
US-10829485-B2 ATF6 inhibitors and uses thereof ATF4, XBP1, ATF1 KDM4E 4305/4885KDM6B 4027/4885KDM4A 4328/4885
US-20210221803-A1 ATF6 INHIBITORS AND USES THEREOF ATF4, XBP1, ATF1 KDM4E 4305/4885KDM6B 4027/4885KDM4A 4328/4885

“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.