SCHEMBL22893604

SCHEMBL22893604

O=C(O)C(c1ccccc1)C1(O)CCNCC1

nearest known ligand 0.72

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.43
CHRM2 P08172 2/20 0.43
CHRM1 P11229 2/20 0.43
CHRM3 P20309 2/20 0.43
USP2 O75604 4/20 0.42
CYP2D6 P10635 4/20 0.42
CYP2C9 P11712 2/20 0.42
CYP1A2 P05177 2/20 0.42
CYP3A4 P08684 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CYP2C19 P33261 1/20 0.41
OPRM1 P35372 2/20 0.40
CHRM4 P08173 1/20 0.40
SRC P12931 1/20 0.39
OPRD1 P41143 1/20 0.39
MAPK1 P28482 1/20 0.38
TP53 P04637 1/20 0.38
ALOX15 P16050 1/20 0.38
MME P08473 1/20 0.37

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
Hydrochloric Acid SCHEMBL20487165 0.98 LMNA (0.44) LMNACHRM2CHRM1CHRM3USP2
SCHEMBL13842135 0.84 LMNA (0.52) LMNACHRM2CHRM1CHRM3CYP2D6
SCHEMBL628303 0.84 LMNA (0.56) LMNACHRM2CHRM1CHRM3CYP2D6
SCHEMBL29845505 0.84 LMNA (0.56) LMNACHRM2CHRM1CHRM3CYP2D6
SCHEMBL13628924 0.82 LMNA (0.55) LMNACHRM2CHRM1CHRM3CYP2D6
SCHEMBL14489601 0.82 LMNA (0.55) LMNACHRM2CHRM1CHRM3CYP2D6
SCHEMBL23813082 0.79 LMNA (0.50) LMNACHRM2CHRM1CHRM3SMN1; SMN2
SCHEMBL7290614 0.75 USP2 (0.45) USP2CYP2D6CYP2C9CYP1A2CYP3A4
SCHEMBL3956434 0.73 CHRM2 (0.47) LMNACHRM2CHRM1CHRM3SMN1; SMN2
SCHEMBL12168378 0.73 OPRM1 (0.48) LMNACHRM2CHRM1CHRM3SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11795167-B2 Inhibitors of (α-v)(β-6) integrin MORPHIC THERAPEUTIC, INC. (US) 2023-10-24 US disclosed
US-11795167-B2 Inhibitors of (α-v)(β-6) integrin MORPHIC THERAPEUTIC, INC. (US) 2023-10-24 US disclosed
US-20210284640-A1 INHIBITORS OF (ALPHA-V)(BETA-6) INTEGRIN Lazuli, Inc. 2021-09-16 US disclosed
US-11046685-B2 Inhibitors of (α-v)(β-6) integrin MORPHIC THERAPEUTIC, INC. (US) 2021-06-29 US disclosed
EP-3760202-A1 INHIBITORS OF (ALPHA-V)(BETA-6) INTEGRIN Morphic Therapeutic, Inc. (US) 2021-01-06 EP 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 (3 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-11046685-B2 Inhibitors of (α-v)(β-6) integrin ITGB6, ITGA6, ITGAV LMNA 2270/4885CHRM2 2084/4885CHRM1 2563/4885
US-20210284640-A1 INHIBITORS OF (ALPHA-V)(BETA-6) INTEGRIN ITGB6, ITGA6, ITGAV LMNA 1894/4885CHRM2 1600/4885CHRM1 2241/4885
US-11795167-B2 Inhibitors of (α-v)(β-6) integrin ITGB6, ITGA6, ITGAV LMNA 2182/4885CHRM2 1883/4885CHRM1 2435/4885

“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.