SCHEMBL23836113

SCHEMBL23836113

CCNC(=O)c1cc2c(OCCN3CCOCC3)cccc2[nH]1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.53
▸ ALDH1A1 P00352 2/20 0.53
▸ HSD17B10 Q99714 1/20 0.53
▸ DRD2 P14416 1/20 0.50
▸ DRD3 P35462 1/20 0.50
▸ PDGFRB P09619 1/20 0.48
▸ PDGFRA P16234 1/20 0.48
▸ MAPT P10636 1/20 0.48
▸ HRH3 Q9Y5N1 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ POLB P06746 2/20 0.46
▸ CNR1 P21554 1/20 0.46
▸ CNR2 P34972 1/20 0.46
▸ MAPK14 Q16539 2/20 0.45
▸ NPC1 O15118 1/20 0.45
▸ RAB9A P51151 1/20 0.45
▸ MAOB P27338 1/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ RXFP1 Q9HBX9 1/20 0.44
▸ CHUK O15111 1/20 0.44

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
SCHEMBL24449992 0.88 DRD2 (0.50) KDM4EALDH1A1HSD17B10DRD2DRD3
SCHEMBL24020775 0.87 DRD2 (0.55) KDM4EALDH1A1HSD17B10DRD2DRD3
SCHEMBL24019681 0.87 DRD2 (0.47) KDM4EALDH1A1HSD17B10DRD2DRD3
SCHEMBL24020774 0.86 SRD5A2 (0.56) KDM4EALDH1A1DRD2DRD3PDGFRB
SCHEMBL25768183 0.82 POLB (0.54) KDM4EDRD2DRD3MAPTKMT2A
SCHEMBL25852999 0.80 HDAC3 (0.58) KDM4EALDH1A1HSD17B10MAPTKMT2A
SCHEMBL24448134 0.76 POLB (0.70) KDM4EMAPTKMT2APOLBNPC1
SCHEMBL4067053 0.74 MAOB (0.53) KDM4EKMT2APOLBCNR1CNR2
SCHEMBL23872966 0.74 CYP2C9 (0.68) ALDH1A1KMT2A
SCHEMBL24739968 0.72 POLB (0.53) KDM4EMAPTKMT2APOLBNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220402896-A1 INHIBITORS OF CYSTEINE PROTEASES AND METHODS OF USE THEREOF Pardes Biosciences, Inc. 2022-12-22 — — US disclosed
US-11312704-B2 Inhibitors of cysteine proteases and methods of use thereof Pardes Biosciences, Inc. (US) 2022-04-26 — — US disclosed
US-20210355111-A1 INHIBITORS OF CYSTEINE PROTEASES AND METHODS OF USE THEREOF Pardes Biosciences, Inc. 2021-11-18 — — US disclosed
US-11124497-B1 Inhibitors of cysteine proteases and methods of use thereof Pardes Biosciences, Inc. (US) 2021-09-21 — — US 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 (4 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-11312704-B2 Inhibitors of cysteine proteases and methods of use thereof CTSV, CTRL, CTSL KDM4E 3025/4885ALDH1A1 1798/4885HSD17B10 966/4885
US-20220402896-A1 INHIBITORS OF CYSTEINE PROTEASES AND METHODS OF USE THEREOF CTSV, CTRL, CTSL KDM4E 3025/4885ALDH1A1 1798/4885HSD17B10 966/4885
US-20210355111-A1 INHIBITORS OF CYSTEINE PROTEASES AND METHODS OF USE THEREOF CTRL, CTSV, CTSL KDM4E 2930/4885ALDH1A1 2252/4885HSD17B10 1711/4885
US-11124497-B1 Inhibitors of cysteine proteases and methods of use thereof CTRL, CTSV, CTSL KDM4E 3119/4885ALDH1A1 1326/4885HSD17B10 1706/4885

“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.

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