SCHEMBL20605026

SCHEMBL20605026

Cc1cc(Br)c2[nH]cc(C(=O)O)c2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MYC P01106 1/20 0.47
▸ CYP1A2 P05177 2/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ CSNK2A2 P19784 4/20 0.41
▸ CSNK2B P67870 4/20 0.41
▸ CSNK2A1 P68400 4/20 0.41
▸ XDH P47989 1/20 0.39
▸ PRKAB2 O43741 1/20 0.38
▸ PRKAG1 P54619 1/20 0.38
▸ PRKAA2 P54646 1/20 0.38
▸ PRKAA1 Q13131 1/20 0.38
▸ PRKAG3 Q9UGI9 1/20 0.38
▸ PRKAG2 Q9UGJ0 1/20 0.38
▸ PRKAB1 Q9Y478 1/20 0.38
▸ NOTUM Q6P988 1/20 0.37
▸ KDM4E B2RXH2 3/20 0.37
▸ ALDH1A1 P00352 2/20 0.37
▸ HPGD P15428 1/20 0.37
▸ MAPT P10636 1/20 0.37

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
SCHEMBL28100587 0.84 XDH (0.38) MYCCYP1A2CYP3A4CYP2C19XDH
SCHEMBL22462503 0.82 AKR1C4 (0.48) CYP1A2CSNK2A2CSNK2BCSNK2A1PRKAB2
SCHEMBL12748347 0.82 CYP1A2 (0.57) CYP1A2CYP3A4CYP2C19CSNK2A2CSNK2B
SCHEMBL23622948 0.79 F7 (0.51) CYP1A2CYP3A4CSNK2A2CSNK2BCSNK2A1
SCHEMBL12748339 0.79 CSNK2A2 (0.54) CYP1A2CYP3A4CYP2C19CSNK2A2CSNK2B
SCHEMBL30689179 0.76 MAPT (0.45) CYP1A2CYP3A4CYP2C19XDHALDH1A1
SCHEMBL17417717 0.75 MYC (0.46) MYCPRKAB2PRKAG1PRKAA2PRKAA1
SCHEMBL20604918 0.74 CYP1A2 (0.46) CYP1A2CYP3A4ALDH1A1MAPTLMNA
SCHEMBL29209733 0.73 ALDH1A1 (0.36) CYP3A4XDHALDH1A1MAPT
SCHEMBL3762044 0.71 KDM4E (0.50) CYP1A2CSNK2A2CSNK2BCSNK2A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12144816-B2 Substituted indole Mcl-1 inhibitors VANDERBILT UNIVERSITY (US) 2024-11-19 — — US disclosed
EP-4292662-A2 SUBSTITUTED INDOLE MCL-1 INHIBITORS Vanderbilt University (US) 2023-12-20 — — EP disclosed
US-20230330099-A1 SUBSTITUTED INDOLE MCL-1 INHIBITORS VANDERBILT UNIVERSITY 2023-10-19 — — US disclosed
EP-3423435-B1 SUBSTITUTED INDOLE MCL-1 INHIBITORS UNIV VANDERBILT (US) 2023-08-23 — — EP disclosed
US-11596639-B2 Substituted indole Mcl-1 inhibitors VANDERBILT UNIVERSITY (US) 2023-03-07 — — US disclosed
CN-109153643-B Substituted indole MCL-1 inhibitors 范德比尔特大学 2022-06-21 — — CN disclosed
US-20210283138-A1 SUBSTITUTED INDOLE MCL-1 INHIBITORS VANDERBILT UNIVERSITY 2021-09-16 — — US disclosed
EP-3423435-A1 SUBSTITUTED INDOLE MCL-1 INHIBITORS Vanderbilt University (US) 2019-01-09 — — 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 (4 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-20210283138-A1 SUBSTITUTED INDOLE MCL-1 INHIBITORS MCL1, BCL2L1, BCL9 MYC 25/4885CYP1A2 4125/4885CYP3A4 4659/4885
US-12144816-B2 Substituted indole Mcl-1 inhibitors MCL1, BCL2L1, BCL9 MYC 25/4885CYP1A2 4125/4885CYP3A4 4659/4885
US-20230330099-A1 SUBSTITUTED INDOLE MCL-1 INHIBITORS MCL1, BCL2L1, BCL9 MYC 25/4885CYP1A2 4125/4885CYP3A4 4659/4885
US-11596639-B2 Substituted indole Mcl-1 inhibitors MCL1, BCL2L1, BCL9 MYC 25/4885CYP1A2 4125/4885CYP3A4 4659/4885

“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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