SCHEMBL29343229

SCHEMBL29343229

CCOC(=O)c1nn(C(F)F)cc1Cc1nc(Br)cs1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADORA1 P30542 4/20 0.36
▸ ADORA3 P0DMS8 3/20 0.36
▸ ADORA2A P29274 3/20 0.36
▸ MAPT P10636 6/20 0.35
▸ ALDH1A1 P00352 4/20 0.35
▸ KDM4E B2RXH2 3/20 0.35
▸ MEN1 O00255 3/20 0.35
▸ KMT2A Q03164 3/20 0.35
▸ HSD17B10 Q99714 3/20 0.35
▸ HPGD P15428 2/20 0.35
▸ LMNA P02545 2/20 0.35
▸ GAA P10253 2/20 0.34
▸ HTT P42858 1/20 0.34
▸ TARBP2 Q15633 1/20 0.34
▸ NPC1 O15118 8/20 0.33
▸ RAB9A P51151 8/20 0.33
▸ POLB P06746 1/20 0.33
▸ PKM P14618 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ RXFP1 Q9HBX9 1/20 0.33

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
SCHEMBL29343231 0.88 GAA (0.33) MAPTALDH1A1KDM4EMEN1KMT2A
SCHEMBL29340018 0.82 — —
SCHEMBL29340019 0.78 — —
SCHEMBL15509273 0.78 NPC1 (0.43) ADORA1ADORA3ADORA2AMAPTALDH1A1
SCHEMBL27163549 0.75 KDM4E (0.38) MAPTALDH1A1KDM4EMEN1KMT2A
SCHEMBL29222044 0.75 SMN1; SMN2 (0.46) ADORA1ADORA3ADORA2AALDH1A1KDM4E
SCHEMBL17162371 0.72 ADORA3 (0.44) ADORA1ADORA3ADORA2AALDH1A1KDM4E
SCHEMBL29343971 0.72 EED (0.41) MAPTALDH1A1MEN1KMT2ALMNA
SCHEMBL29344168 0.71 NPY1R (0.39) MAPTALDH1A1KDM4EMEN1KMT2A
SCHEMBL29343318 0.71 GABRG2 (0.38) MAPTALDH1A1KDM4EMEN1KMT2A

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-20240239774-A1 SOLUBLE ADENYLYL CYCLASE (SAC) INHIBITORS AND USES THEREOF CORNELL UNIVERSITY (US) 2024-07-18 — — 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-20240239774-A1 SOLUBLE ADENYLYL CYCLASE (SAC) INHIBITORS AND USES THEREOF UACA, ADCYAP1R1, ADCY1 ADORA1 804/4885ADORA3 1081/4885ADORA2A 1052/4885

“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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