SCHEMBL29872618

SCHEMBL29872618

COc1ccc(Cn2nc(OC(F)F)c3cc(Oc4ccc(N)cc4)cnc32)cc1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 1/20 0.39
▸ CNR2 P34972 1/20 0.39
▸ PDE5A O76074 1/20 0.39
▸ BTK Q06187 1/20 0.39
▸ NPBWR1 P48145 8/20 0.37
▸ MAPT P10636 3/20 0.37
▸ ALDH1A1 P00352 2/20 0.37
▸ LMNA P02545 2/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ PDE1B Q01064 5/20 0.36
▸ HTR6 P50406 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ ALOX15 P16050 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ MCHR1 Q99705 1/20 0.34
▸ POLB P06746 1/20 0.34

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
SCHEMBL29873129 0.86 MAPT (0.46) CNR1CNR2PDE5AMAPTLMNA
SCHEMBL23069175 0.83 CNR1 (0.43) CNR1CNR2PDE5ANPBWR1MAPT
SCHEMBL29872929 0.83 NPBWR1 (0.43) CNR1CNR2PDE5ABTKNPBWR1
SCHEMBL29873478 0.83 CNR1 (0.43) CNR1CNR2PDE5ANPBWR1MAPT
SCHEMBL29872865 0.83 PDE1B (0.50) CNR1CNR2PDE5ANPBWR1MAPT
SCHEMBL29872986 0.83 CNR2 (0.45) CNR1CNR2PDE5AMAPTALDH1A1
SCHEMBL23069164 0.83 PDE1B (0.50) CNR1CNR2PDE5ANPBWR1MAPT
SCHEMBL29872989 0.82 BUB1 (0.40) CNR1CNR2PDE5AMAPTALDH1A1
SCHEMBL29873329 0.78 NPBWR1 (0.37) PDE5ANPBWR1ALDH1A1LMNASMN1; SMN2
SCHEMBL1593023 0.78 CNR1 (0.47) CNR1CNR2PDE5ANPBWR1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220306640-A1 HYDANTOIN DERIVATIVE ONO PHARMACEUTICAL CO., LTD. (JP) 2022-09-29 — — 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 (1 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-20220306640-A1 HYDANTOIN DERIVATIVE DDR1, DDR2, DDRGK1 CNR1 2761/4885CNR2 3824/4885PDE5A 1929/4885

“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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