SCHEMBL29343659

SCHEMBL29343659

C=CCOc1ccc(F)cc1Cc1cn(C)nc1C(=O)OCC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 2/20 0.40
▸ RAB9A P51151 2/20 0.40
▸ LMNA P02545 1/20 0.40
▸ ADORA2A P29274 2/20 0.39
▸ KMT2A Q03164 3/20 0.38
▸ GABRA2 P47869 2/20 0.38
▸ GABRB2 P47870 2/20 0.38
▸ MEN1 O00255 2/20 0.38
▸ TSHR P16473 2/20 0.38
▸ GABRP O00591 1/20 0.38
▸ GABRD O14764 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ CYP2D6 P10635 1/20 0.38
▸ GABRA1 P14867 1/20 0.38
▸ GABRB1 P18505 1/20 0.38
▸ GABRG2 P18507 1/20 0.38
▸ GABRB3 P28472 1/20 0.38
▸ GABRA5 P31644 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38

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
SCHEMBL29343655 0.90 HTR2A (0.37) NPC1RAB9ALMNAADORA2AKMT2A
SCHEMBL29343102 0.89 ALDH1A1 (0.39) NPC1RAB9ALMNAADORA2AKMT2A
SCHEMBL29340178 0.85 HTR2A (0.39) KMT2AMEN1TSHRALDH1A1CYP1A2
SCHEMBL29340183 0.82 MAPT (0.40) KMT2AMEN1ALDH1A1KDM4EMAPT
SCHEMBL29343658 0.80 NPC1 (0.39) NPC1RAB9ALMNAADORA2AKMT2A
SCHEMBL29343103 0.77 ALDH1A1 (0.39) NPC1RAB9ALMNAKMT2AMEN1
SCHEMBL29342738 0.77 ADRB2 (0.38) NPC1RAB9ALMNAKMT2AMEN1
SCHEMBL29343101 0.73 ADRB2 (0.39) NPC1RAB9ALMNAADORA2AKMT2A
SCHEMBL29343015 0.72 KMT2A (0.36) NPC1RAB9ALMNAKMT2AGABRA2
SCHEMBL29340007 0.72 LIG1 (0.39) LMNAKMT2AMEN1TSHRALDH1A1

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 NPC1 496/4885RAB9A 690/4885LMNA 3019/4885

“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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