SCHEMBL18172999

SCHEMBL18172999

COCC/C(=C\c1ccccc1)C(=O)OC

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.50
APEX1 P27695 4/20 0.49
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
CYP3A4 P08684 1/20 0.44
CYP2C9 P11712 1/20 0.44
LMNA P02545 1/20 0.43
MAPT P10636 1/20 0.42
THRB P10828 1/20 0.42
MME P08473 2/20 0.41
AKR1C3 P42330 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
SCHEMBL18172997 1.00 RECQL (0.50) RECQLAPEX1MEN1KMT2ACYP3A4
SCHEMBL18173002 1.00 RECQL (0.50) RECQLAPEX1MEN1KMT2ACYP3A4
SCHEMBL11818250 0.85 RECQL (0.51) RECQLMEN1KMT2ACYP3A4CYP2C9
SCHEMBL11818255 0.85 RECQL (0.51) RECQLMEN1KMT2ACYP3A4CYP2C9
SCHEMBL27794124 0.83 RECQL (0.53) RECQLMEN1KMT2ACYP3A4CYP2C9
SCHEMBL28233383 0.83 CYP3A4 (0.50) RECQLMEN1KMT2ACYP3A4CYP2C9
SCHEMBL19456098 0.83 CYP3A4 (0.50) RECQLMEN1KMT2ACYP3A4CYP2C9
SCHEMBL7471879 0.82 KMT2A (0.45) RECQLMEN1KMT2ACYP3A4CYP2C9
SCHEMBL7471887 0.82 KMT2A (0.45) RECQLMEN1KMT2ACYP3A4CYP2C9
SCHEMBL7471890 0.82 KMT2A (0.45) RECQLMEN1KMT2ACYP3A4CYP2C9

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 6 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
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
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 RECQL 2581/4885APEX1 2825/4885MEN1 3493/4885

“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.