SCHEMBL18172680

SCHEMBL18172680

CC(C)(CO)C(=O)N1CCC(C(=O)O)CC1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.42
HSD17B10 Q99714 1/20 0.42
POLB P06746 2/20 0.41
RAB9A P51151 2/20 0.40
NPC1 O15118 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.39
PRSS1 P07477 1/20 0.39
TMPRSS15 P98073 1/20 0.39
ALDH1A1 P00352 1/20 0.39

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
SCHEMBL8237515 0.87 LMNA (0.53) LMNAL3MBTL1HSD17B10POLBRAB9A
SCHEMBL8237599 0.84 LMNA (0.50) LMNAL3MBTL1HSD17B10POLBRAB9A
SCHEMBL17546278 0.83 ALDH1A1 (0.48) LMNANPC1GAAMAPTALDH1A1
SCHEMBL12308632 0.83 LMNA (0.49) LMNAL3MBTL1HSD17B10POLBRAB9A
SCHEMBL7307925 0.82 LMNA (0.59) LMNAL3MBTL1HSD17B10POLBRAB9A
SCHEMBL18173239 0.80 MAPT (0.59) POLBNPC1GAAMAPTALDH1A1
SCHEMBL14231009 0.80 AKR1C3 (0.39) LMNA
SCHEMBL5606073 0.79 LMNA (0.56) LMNAL3MBTL1HSD17B10POLBRAB9A
SCHEMBL20955956 0.79 PDK2 (0.54) LMNA
SCHEMBL20955955 0.79 PDK2 (0.54) LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3286172-B1 LSD1 INHIBITORS AND USES THEREOF CONSTELLATION PHARMACEUTICALS INC (US) 2019-06-12 EP disclosed
US-20180290976-A1 LSD1 INHIBITORS AND USES THEREOF CONSTELLATION PHARMACEUTICALS, INC. 2018-10-11 US disclosed
EP-3286172-A1 LSD1 INHIBITORS AND USES THEREOF Constellation Pharmaceuticals, Inc. (US) 2018-02-28 EP disclosed
WO-2016172496-A1 LSD1 INHIBITORS AND USES THEREOF CONSTELLATION PHARMACEUTICALS, INC. (US) 2016-10-27 WO 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-20180290976-A1 LSD1 INHIBITORS AND USES THEREOF KDM1B, KDM1A, KDM2A LMNA 1196/4885L3MBTL1 633/4885HSD17B10 474/4885

“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.