SCHEMBL469938

SCHEMBL469938

Cc1cc(C)c2ncc(C)n2n1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.41
MAPT P10636 1/20 0.41
CYP1A2 P05177 1/20 0.35
PDE10A Q9Y233 5/20 0.35
UHRF1 Q96T88 1/20 0.34
LMNA P02545 1/20 0.33
TSHR P16473 2/20 0.33
HSD17B10 Q99714 1/20 0.33
HTT P42858 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
ALDH1A1 P00352 1/20 0.31
GLA P06280 1/20 0.31

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
SCHEMBL19336865 0.80 KDM4E (0.43) KDM4EMAPTCYP1A2UHRF1LMNA
SCHEMBL469978 0.77 TYK2 (0.39) CYP1A2PDE10A
SCHEMBL19554510 0.74 CYP1A2 (0.40) KDM4EMAPTCYP1A2LMNAALDH1A1
SCHEMBL19336869 0.73 TYK2 (0.43) CYP1A2PDE10ALMNATSHRHSD17B10
SCHEMBL3018000 0.68 PDE10A (0.36) PDE10ALMNA
SCHEMBL19578170 0.68 PDE10A (0.36) PDE10A
SCHEMBL12547356 0.67 RECQL (0.35) KDM4ECYP1A2HTTMEN1KMT2A
SCHEMBL25948904 0.67 KDM4E (0.36) KDM4EMAPTCYP1A2UHRF1HSD17B10
SCHEMBL25948845 0.67 PDE10A (0.37) PDE10A
SCHEMBL3025259 0.66 PDE10A (0.34) MAPTPDE10ALMNAKMT2A

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-20230242533-A9 SUBSTITUTED FUSED HETEROAROMATIC BICYCLIC COMPOUNDS AS KINASE INHIBITORS AND THE USE THEREOF Impact Therapeutics (Shanghai), Inc (CN) 2023-08-03 US disclosed
US-20170305912-A1 PROCESS FOR THE PREPARATION OF 3-PHENYL/HETEROARYL-6-PHENOXY-8-ALKYLAMINO-IMIDAZO[1,2-B]PYRIDAZINE DERIVATIVES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2017-10-26 US disclosed
WO-2012032031-A1 SUBSTITUTED IMIDAZOPYRIDAZINES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2012-03-15 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-20230242533-A9 SUBSTITUTED FUSED HETEROAROMATIC BICYCLIC COMPOUNDS AS KINASE INHIBITORS AND THE USE THEREOF ATR, CHEK1, CHEK2 KDM4E 1516/4885MAPT 3191/4885CYP1A2 2046/4885
US-20170305912-A1 PROCESS FOR THE PREPARATION OF 3-PHENYL/HETEROARYL-6-PHENOXY-8-ALKYLAMINO-IMIDAZO[1,2-B]PYRIDAZINE DERIVATIVES TTBK1, TTK, TTBK2 KDM4E 1622/4885MAPT 843/4885CYP1A2 1976/4885

“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.