SCHEMBL20180600

SCHEMBL20180600

Cc1ccc(N2C[C@@H](C)N(C)[C@@H](C)C2)c(C(F)(F)F)c1

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
WDR5 P61964 9/20 0.41
HSD11B1 P28845 3/20 0.39
NOTUM Q6P988 1/20 0.39
HTR1D P28221 3/20 0.38
HTR1B P28222 3/20 0.38
SYK P43405 1/20 0.38
PHGDH O43175 1/20 0.37
RBP4 P02753 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
SCHEMBL16541456 0.83 TP53 (0.44) WDR5HSD11B1NOTUMHTR1DHTR1B
SCHEMBL17708399 0.83 RBP4 (0.40) HSD11B1NOTUMSYKPHGDHRBP4
SCHEMBL26406990 0.82 HSD11B1 (0.40) WDR5HSD11B1NOTUMHTR1DHTR1B
SCHEMBL24123786 0.82 HSD11B1 (0.40) WDR5HSD11B1NOTUMHTR1DHTR1B
SCHEMBL24123780 0.81 HTR2C (0.40) NOTUMSYKPHGDHRBP4
SCHEMBL20648858 0.81 ACACB (0.39) WDR5
SCHEMBL20180602 0.80 ALDH1A1 (0.42)
SCHEMBL22765834 0.79 HSD11B1 (0.46) WDR5HSD11B1HTR1DHTR1BRBP4
SCHEMBL12017807 0.78 ADRB2 (0.55)
SCHEMBL23262620 0.78 HTR1B (0.34) HTR1B

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-10703759-B2 8,9-dihydroimidazo[1,2-a]pyrimido[5,4-e]pyrimidin-5(6H)-ones IMPACT THERAPEUTICS, INC (CN) 2020-07-07 US disclosed
US-20190308984-A1 8,9-DIHYDROIMIDAZO[1,2-a]PYRIMIDO[5,4-e]PYRIMIDIN-5(6H)-ONES Impact Therapeutics (Shanghai), Inc (CN) 2019-10-10 US disclosed
WO-2018090939-A1 8,9-DIHYDROIMIDAZOLE[1,2-A]PYRIMIDO[5,4-E]PYRIMIDINE-5(6H)-KETONE COMPOUND 上海瑛派药业有限公司 2018-05-24 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-20190308984-A1 8,9-DIHYDROIMIDAZO[1,2-a]PYRIMIDO[5,4-e]PYRIMIDIN-5(6H)-ONES WEE1, WEE2, CCNE1 WDR5 317/4885HSD11B1 2836/4885NOTUM 366/4885
US-10703759-B2 8,9-dihydroimidazo[1,2-a]pyrimido[5,4-e]pyrimidin-5(6H)-ones WEE1, WEE2, CCNE1 WDR5 317/4885HSD11B1 2836/4885NOTUM 366/4885

“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.