SCHEMBL19975232

SCHEMBL19975232

CC(C)C(NCC(C)(C)C)C(O)C(=O)NCC1CC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.40
TDP1 Q9NUW8 1/20 0.35
KCNH2 Q12809 3/20 0.34
CACNA1I Q9P0X4 3/20 0.34
MEN1 O00255 2/20 0.32
ATM Q13315 2/20 0.32
ALDH1A1 P00352 1/20 0.32
LIPE Q05469 1/20 0.32
CYP3A4 P08684 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
F10 P00742 2/20 0.31
PRSS1 P07477 2/20 0.31
PSEN1 P49768 1/20 0.31
PSEN2 P49810 1/20 0.31
APH1B Q8WW43 1/20 0.31
NCSTN Q92542 1/20 0.31
APH1A Q96BI3 1/20 0.31
PSENEN Q9NZ42 1/20 0.31
OPRD1 P41143 1/20 0.31
OPRK1 P41145 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
SCHEMBL19975306 0.85 KMT2A (0.41) KMT2ATDP1KCNH2CACNA1IMEN1
SCHEMBL19975109 0.82 TDP1 (0.37) KMT2ATDP1MEN1ALDH1A1LIPE
SCHEMBL19975367 0.79 NPC1 (0.34) KMT2ATDP1MEN1LIPECYP3A4
SCHEMBL19975079 0.72 KMT2A (0.43) KMT2ATDP1KCNH2CACNA1IMEN1
SCHEMBL19975154 0.72 TDP1 (0.46) KMT2ATDP1MEN1ALDH1A1SMN1; SMN2
SCHEMBL19974699 0.72 TDP1 (0.48) KMT2ATDP1SMN1; SMN2F10PRSS1
SCHEMBL19975518 0.71 KMT2A (0.44) KMT2ATDP1MEN1ATMALDH1A1
SCHEMBL28316928 0.70 TDP1 (0.50) KMT2ATDP1MEN1ALDH1A1CYP3A4
SCHEMBL19975390 0.70 TDP1 (0.42) KMT2ATDP1MEN1ALDH1A1SMN1; SMN2
SCHEMBL19974679 0.69 KMT2A (0.36) KMT2ATDP1SMN1; SMN2F10PRSS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220356148-A1 ANTIVIRAL COMPOUNDS HAPLOGEN GMBH (AT) 2022-11-10 US disclosed
US-11091428-B2 Antiviral compounds HAPLOGEN GMBH (AT) 2021-08-17 US disclosed
US-11091428-B2 Antiviral compounds HAPLOGEN GMBH (AT) 2021-08-17 US disclosed
US-20190225575-A1 ANTIVIRAL COMPOUNDS LUNIS CONSULTING GMBH (AT) 2019-07-25 US disclosed
US-20190225575-A1 ANTIVIRAL COMPOUNDS LUNIS CONSULTING GMBH (AT) 2019-07-25 US disclosed
EP-3512836-A1 ANTIVIRAL COMPOUNDS Haplogen GmbH (AT) 2019-07-24 EP disclosed
WO-2018050631-A1 ANTIVIRAL COMPOUNDS HAPLOGEN GMBH (AT) 2018-03-22 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-20190225575-A1 ANTIVIRAL COMPOUNDS PLA2G1B, PLA2G12A, PLA2G4C KMT2A 4031/4885TDP1 1016/4885KCNH2 3665/4885
US-20220356148-A1 ANTIVIRAL COMPOUNDS PLA2G12A, PLA2G1B, PLA2G4C KMT2A 4177/4885TDP1 911/4885KCNH2 3368/4885
US-11091428-B2 Antiviral compounds PLA2G1B, PLA2G12A, PLA2G4C KMT2A 4031/4885TDP1 1016/4885KCNH2 3665/4885

“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.