SCHEMBL18173299

SCHEMBL18173299

CCC(=Cc1ccccc1)C1CC1C(=O)N=[N+]=[N-]

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 13/20 0.55
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
RAB9A P51151 2/20 0.33
AKR1C3 P42330 1/20 0.33
NPC1 O15118 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
RECQL P46063 1/20 0.33
MAPT P10636 1/20 0.32
HPGD P15428 1/20 0.32

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
SCHEMBL18173297 1.00 KDM1A (0.55) KDM1AMEN1KMT2ARAB9AAKR1C3
SCHEMBL18182254 0.87 KDM1A (0.55) KDM1AMEN1KMT2ARAB9AAKR1C3
SCHEMBL18173156 0.83 KDM1A (0.51) KDM1ARAB9AAKR1C3NPC1RECQL
SCHEMBL18173154 0.83 KDM1A (0.51) KDM1ARAB9AAKR1C3NPC1RECQL
SCHEMBL18172749 0.82 KDM1A (0.69) KDM1AMEN1KMT2AAKR1C3RECQL
SCHEMBL20527481 0.82 KDM1A (0.69) KDM1AMEN1KMT2AAKR1C3RECQL
SCHEMBL18172746 0.82 KDM1A (0.69) KDM1AMEN1KMT2AAKR1C3RECQL
SCHEMBL18172743 0.82 KDM1A (0.69) KDM1AMEN1KMT2AAKR1C3RECQL
SCHEMBL18172741 0.82 KDM1A (0.69) KDM1AMEN1KMT2AAKR1C3RECQL
SCHEMBL18173120 0.80 KDM1A (0.35) KDM1AMEN1KMT2ARAB9AAKR1C3

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 KDM1A 2/4885MEN1 3493/4885KMT2A 26/4885

“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.