SCHEMBL20074293

SCHEMBL20074293

O=c1cc(-c2cccc(F)c2)[nH]c2ncnn12

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
EGLN2 Q96KS0 1/20 0.48
ALDH1A1 P00352 5/20 0.44
HPGD P15428 4/20 0.44
LMNA P02545 4/20 0.44
MEN1 O00255 1/20 0.41
THRB P10828 1/20 0.41
KMT2A Q03164 1/20 0.41
KDM4E B2RXH2 3/20 0.40
MAPKAPK2 P49137 2/20 0.40
MAPT P10636 1/20 0.40
KDM5B Q9UGL1 1/20 0.40
IDO1 P14902 1/20 0.39
LDHA P00338 1/20 0.39
AHR P35869 1/20 0.39
PKM P14618 1/20 0.39
PTGS2 P35354 1/20 0.38
MAPK1 P28482 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL20074186 0.85 KIT (0.41) EGLN2ALDH1A1HPGDLMNAKDM4E
SCHEMBL20074288 0.84 KDM4E (0.50) EGLN2ALDH1A1HPGDLMNAMEN1
SCHEMBL20074290 0.84 EGLN2 (0.48) EGLN2MEN1KMT2AMAPKAPK2KDM5B
SCHEMBL31677015 0.78 SMN1; SMN2 (0.45) ALDH1A1KMT2AMAPKAPK2SMN1; SMN2
SCHEMBL20074201 0.77 CDC7 (0.40) ALDH1A1HPGDLMNAKDM4EMAPKAPK2
SCHEMBL2197782 0.77 LMNA (0.47) EGLN2HPGDLMNAMEN1KMT2A
SCHEMBL20074296 0.76 CHEK1 (0.42) EGLN2ALDH1A1HPGDMEN1THRB
SCHEMBL31677033 0.76 TSHR (0.36) ALDH1A1HPGDLMNAMEN1KMT2A
SCHEMBL15657910 0.74 KDM4E (0.46) ALDH1A1HPGDTHRBKMT2AKDM4E
SCHEMBL15659549 0.73 ALDH1A1 (0.51) EGLN2ALDH1A1HPGDLMNAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10975084-B2 KDM5 inhibitors MERCK SHARP & DOHME CORP. (US) 2021-04-13 US disclosed
US-20200048258-A1 KDM5 INHIBITORS MERCK SHARP & DOHME CORP. (US) 2020-02-13 US disclosed
WO-2018071283-A1 KDM5 INHIBITORS MERCK SHARP & DOHME CORP. (US) 2018-04-19 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-20200048258-A1 KDM5 INHIBITORS KDM5A, KDM5B, KDM5C EGLN2 600/4885ALDH1A1 1399/4885HPGD 3907/4885
US-10975084-B2 KDM5 inhibitors KDM5A, KDM5B, KDM5C EGLN2 600/4885ALDH1A1 1399/4885HPGD 3907/4885

“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.