SCHEMBL21755153

SCHEMBL21755153

CCCCC(CC)c1ccc(F)cn1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 3/20 0.40
ESR2 Q92731 3/20 0.40
APLNR P35414 2/20 0.38
LMNA P02545 1/20 0.32
NR1I2 O75469 1/20 0.32
HRH1 P35367 1/20 0.32
KCNH2 Q12809 1/20 0.32
DHFR P00374 1/20 0.32
HTR7 P34969 1/20 0.31
TSHR P16473 1/20 0.31
HMGCR P04035 1/20 0.30
JAK2 O60674 1/20 0.30
JAK3 P52333 1/20 0.30

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
SCHEMBL19853068 0.93 APLNR (0.40) ESR1ESR2APLNRLMNAHRH1
SCHEMBL20376381 0.90 APLNR (0.38) ESR1ESR2APLNRHRH1KCNH2
SCHEMBL18948514 0.90 ESR1 (0.41) ESR1ESR2APLNRHRH1KCNH2
SCHEMBL25898707 0.89 APLNR (0.37) ESR1ESR2APLNRNR1I2
SCHEMBL18672471 0.89 APLNR (0.37) ESR1ESR2APLNRNR1I2
SCHEMBL23871060 0.87 APLNR (0.38) ESR1ESR2APLNRNR1I2HRH1
SCHEMBL18596818 0.87 APLNR (0.38) ESR1ESR2APLNRNR1I2HRH1
SCHEMBL18948485 0.87 APLNR (0.38) ESR1ESR2APLNRNR1I2HRH1
SCHEMBL19523028 0.86 ESR1 (0.46) ESR1ESR2APLNRHRH1KCNH2
SCHEMBL22166120 0.84 APLNR (0.36) ESR1ESR2APLNRNR1I2

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-20230174553-A1 TYK2 INHIBITORS AND USES THEREOF SUDO BIOSCIENCES LIMITED (GB) 2023-06-08 US disclosed
US-10570153-B2 Benzodiazepine derivatives as RSV inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2020-02-25 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 (2 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-20230174553-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 ESR1 3424/4885ESR2 1986/4885APLNR 4684/4885
US-10570153-B2 Benzodiazepine derivatives as RSV inhibitors GABRA5, GABRA1, GABBR2 ESR1 964/4885ESR2 979/4885APLNR 4738/4885

“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.