SCHEMBL19047906

SCHEMBL19047906

NC1CCN(CCNc2ccc(N3CCCC3=O)cc2)CC1

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KDM1A O60341 9/20 0.62
▸ ALDH1A1 P00352 4/20 0.50
▸ MAPT P10636 2/20 0.46
▸ RECQL P46063 1/20 0.46
▸ NPC1 O15118 4/20 0.44
▸ HPGD P15428 3/20 0.44
▸ SMN1; SMN2 Q16637 3/20 0.44
▸ RAB9A P51151 3/20 0.44
▸ TSHR P16473 2/20 0.44
▸ TP53 P04637 2/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ MAOB P27338 1/20 0.41
▸ GLA P06280 1/20 0.41
▸ PKM P14618 1/20 0.41

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
SCHEMBL19047562 0.96 KDM1A (0.63) KDM1AALDH1A1MAPTRECQLNPC1
SCHEMBL19047885 0.82 KDM1A (0.64) KDM1AMAOB
SCHEMBL19047900 0.82 KDM1A (0.64) KDM1A
SCHEMBL19047563 0.81 KDM1A (0.62) KDM1A
SCHEMBL13462715 0.80 KDM1A (0.44) KDM1AALDH1A1MAPTNPC1HPGD
SCHEMBL13439230 0.80 KDM1A (0.44) KDM1AALDH1A1MAPTNPC1HPGD
SCHEMBL19048065 0.80 KDM1A (0.63) KDM1AMAOB
SCHEMBL22065525 0.79 KDM1A (0.62) KDM1AALDH1A1SMN1; SMN2PKM
SCHEMBL19047887 0.78 KDM1A (0.58) KDM1AALDH1A1MAPTSMN1; SMN2TSHR
SCHEMBL19025249 0.77 KDM1A (1.00) KDM1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3397616-B1 LSD1 INHIBITORS MIRATI THERAPEUTICS INC (US) 2020-06-10 — — EP disclosed
US-9809541-B2 LSD1 inhibitors Mirati Therapeutics, Inc. (US) 2017-11-07 — — US disclosed
US-20170183308-A1 LSD1 Inhibitors Mirati Therapeutics, Inc. (US) 2017-06-29 — — 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-20170183308-A1 LSD1 Inhibitors KDM1B, KDM1A, KDM3A KDM1A 2/4885ALDH1A1 364/4885MAPT 1949/4885

“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.

Send feedback