SCHEMBL26525656

SCHEMBL26525656

CC(C)c1ccc(OC2CC2)c(-c2ccccc2)c1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 1/20 0.49
PDE4A P27815 6/20 0.40
METAP2 P50579 1/20 0.40
IKBKB O14920 3/20 0.40
CHUK O15111 3/20 0.40
LCK P06239 1/20 0.40
ROCK1 Q13464 1/20 0.40
FFAR1 O14842 1/20 0.38
CASR P41180 2/20 0.37
PDE4D Q08499 2/20 0.37
PDE4B Q07343 1/20 0.37
PDE4C Q08493 1/20 0.37
CYP2D6 P10635 1/20 0.37
SLC6A4 P31645 1/20 0.36
HTR2C P28335 1/20 0.36
HTR2B P41595 1/20 0.36

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
SCHEMBL23717048 0.84 CYP11B1 (0.47) PDE4AIKBKBCHUKLCKROCK1
SCHEMBL23717043 0.81 ROCK2 (0.39) PDE4AROCK1PDE4DPDE4BPDE4C
SCHEMBL24984553 0.80 HRH1 (0.53) HRH1IKBKBCHUKLCKROCK1
SCHEMBL11951612 0.79 CASR (0.53) CASR
SCHEMBL24345432 0.79 HTR2C (0.45) PDE4APDE4DPDE4BPDE4CSLC6A4
SCHEMBL7227806 0.76 HRH1 (0.76) HRH1PDE4AIKBKBCHUKLCK
SCHEMBL27425814 0.75 PDE4A (0.46) PDE4AFFAR1PDE4DPDE4BPDE4C
SCHEMBL27427439 0.74 PDE4A (0.46) PDE4AFFAR1PDE4DPDE4BPDE4C
SCHEMBL14268228 0.74 ACACB (0.39) PDE4ASLC6A4HTR2CHTR2B
SCHEMBL16942606 0.74 PDE4A (0.48) PDE4APDE4DPDE4BPDE4CHTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230125803-A1 ANTIVIRAL HETEROCYCLIC COMPOUNDS ENANTA PHARM INC (US) 2023-04-27 US disclosed
US-20230125803-A1 ANTIVIRAL HETEROCYCLIC COMPOUNDS ENANTA PHARM INC (US) 2023-04-27 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-20230125803-A1 ANTIVIRAL HETEROCYCLIC COMPOUNDS ACE, HPRT1, ACE2 HRH1 17/4885PDE4A 961/4885METAP2 223/4885

“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.