SCHEMBL1343638

SCHEMBL1343638

NC1=C2c3ccccc3Oc3ccccc3N2CC=C1

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
P2RX4 Q99571 9/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2D6 P10635 1/20 0.37
SETD7 Q8WTS6 1/20 0.33
KDM4E B2RXH2 1/20 0.32
MAPK1 P28482 1/20 0.32
ATM Q13315 1/20 0.32
DRD2 P14416 2/20 0.31
DRD4 P21917 2/20 0.31
P2RX1 P51575 1/20 0.31
P2RX3 P56373 1/20 0.31
NPC1 O15118 1/20 0.30
LMNA P02545 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
HDAC4 P56524 1/20 0.30
HDAC8 Q9BY41 1/20 0.30
HRH4 Q9H3N8 1/20 0.30

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
SCHEMBL1343091 0.75 MAOA (0.38) CYP2D6SETD7NPC1
SCHEMBL30171415 0.71 P2RX4 (0.35) P2RX4KDM4EDRD2DRD4SMN1; SMN2
SCHEMBL1343635 0.70 P2RX4 (0.35) P2RX4CYP1A2CYP2D6SETD7KDM4E
SCHEMBL1344339 0.68 DRD2 (0.38) P2RX4CYP1A2CYP2D6SETD7KDM4E
SCHEMBL5655144 0.65 ABCG2 (0.32)
SCHEMBL2854510 0.64 P2RX4 (0.35) P2RX4
SCHEMBL28769772 0.62 CYP1A2 (0.56) P2RX4CYP1A2CYP2D6SETD7KDM4E
SCHEMBL10586348 0.61 P2RX4 (0.48) P2RX4P2RX1P2RX3SMN1; SMN2
SCHEMBL19537981 0.59 MAPK1 (0.61) P2RX4CYP1A2CYP2D6SETD7KDM4E
SCHEMBL5693983 0.59 MAPK1 (0.61) P2RX4CYP1A2CYP2D6SETD7KDM4E

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-2155757-B1 NEW PROGESTERONE RECEPTOR MODULATORS MSD OSS BV (NL) 2012-10-31 EP disclosed
US-8063037-B2 Progesterone receptor modulators N. V. ORGANON (NL) 2011-11-22 US disclosed
US-20090054400-A1 NEW PROGESTERONE RECEPTOR MODULATORS N.V. ORGANON 2009-02-26 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-20090054400-A1 NEW PROGESTERONE RECEPTOR MODULATORS PGR, PGRMC2, PGRMC1 P2RX4 285/4885CYP1A2 449/4885CYP2D6 534/4885

“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.