SCHEMBL23623596

SCHEMBL23623596

O=C(NCc1cc(-c2cccs2)[nH]n1)c1cc(C(F)(F)F)ccc1N1CCCC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.46
SRPK1 Q96SB4 3/20 0.42
KDR P35968 1/20 0.42
SRPK2 P78362 1/20 0.42
SRPK3 Q9UPE1 1/20 0.42
KMT2A Q03164 5/20 0.42
MEN1 O00255 3/20 0.40
SORT1 Q99523 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
MAPT P10636 4/20 0.40
HTT P42858 2/20 0.40
NPSR1 Q6W5P4 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
LMNA P02545 2/20 0.40
POLB P06746 1/20 0.40

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
SCHEMBL23623257 0.91 HDAC3 (0.40) KDM4ESRPK1KDRSRPK2SRPK3
SCHEMBL23623339 0.88 ALDH1A1 (0.43) KDM4EKMT2AMEN1L3MBTL1MAPT
SCHEMBL23611734 0.87 ALDH1A1 (0.42) KDM4EKMT2AMEN1L3MBTL1MAPT
SCHEMBL29930673 0.87 ALDH1A1 (0.42) KDM4EKMT2AMEN1L3MBTL1MAPT
SCHEMBL23623306 0.86 KMT2A (0.46) KDM4EKMT2AMEN1L3MBTL1MAPT
SCHEMBL23623631 0.85 KMT2A (0.45) KDM4EKMT2AMEN1L3MBTL1MAPT
SCHEMBL23623240 0.85 KMT2A (0.45) KDM4EKMT2AMEN1L3MBTL1MAPT
SCHEMBL23623320 0.84 KMT2A (0.40) KDM4EKMT2AMEN1L3MBTL1MAPT
SCHEMBL23623262 0.82 KMT2A (0.40) KDM4EKMT2AMEN1L3MBTL1MAPT
SCHEMBL23623260 0.81 CRHBP (0.41) KDM4EKMT2AMEN1L3MBTL1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023091590-A1 COMPOUNDS FOR USE IN TREATING GASTRIC CANCER BERG LLC (US) 2023-05-25 WO disclosed
US-20220002255-A1 UBE2K MODULATORS AND METHODS FOR THEIR USE THLIVERIS, ANDREW T. 2022-01-06 US disclosed
US-11091447-B2 UBE2K modulators and methods for their use BERG LLC (US) 2021-08-17 US disclosed
US-20210214320-A1 UBE2K MODULATORS AND METHODS FOR THEIR USE THLIVERIS, ANDREW T. 2021-07-15 US disclosed
WO-2021138540-A1 POLYCYCLIC AMIDES AS UBE2K MODULATORS FOR TREATING CANCER BERG LLC (US) 2021-07-08 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 (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-11091447-B2 UBE2K modulators and methods for their use UBE2N, UBE2B, UBE2E1 KDM4E 579/4885SRPK1 866/4885KDR 3875/4885
US-20220002255-A1 UBE2K MODULATORS AND METHODS FOR THEIR USE UBE2N, UBE2B, UBE2E1 KDM4E 579/4885SRPK1 866/4885KDR 3875/4885
US-20210214320-A1 UBE2K MODULATORS AND METHODS FOR THEIR USE UBE2N, UBE2B, UBE2E1 KDM4E 579/4885SRPK1 866/4885KDR 3875/4885

“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.