SCHEMBL8530899

SCHEMBL8530899

Cc1cn(C(=O)OCc2ccccc2)c2ccccc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.48
MAOA P21397 1/20 0.48
RCOR1 Q9UKL0 1/20 0.48
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
ALDH1A1 P00352 3/20 0.46
KMT2A Q03164 5/20 0.46
MEN1 O00255 4/20 0.46
TACR3 P29371 1/20 0.45
TFPI2 P48307 1/20 0.44
HTR2C P28335 1/20 0.44
P2RX4 Q99571 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
RECQL P46063 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
P2RX1 P51575 1/20 0.43
P2RX3 P56373 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
MAPK1 P28482 1/20 0.41
SLC6A2 P23975 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
SCHEMBL2114760 0.86 L3MBTL1 (0.54) RAB9AALDH1A1KMT2AMEN1TFPI2
SCHEMBL8530895 0.84 KDM1A (0.49) KDM1AMAOARCOR1NPC1RAB9A
SCHEMBL13309267 0.83 NPC1 (0.48) KDM1AMAOARCOR1NPC1RAB9A
SCHEMBL9572545 0.83 KDM1A (0.57) KDM1AMAOARCOR1ALDH1A1KMT2A
SCHEMBL16399234 0.83 TACR3 (0.53) KDM1AMAOARCOR1NPC1RAB9A
SCHEMBL29123347 0.82 SRD5A1 (0.44) NPC1RAB9AALDH1A1KMT2AMEN1
SCHEMBL9027466 0.82 ALDH1A1 (0.49) KDM1AMAOARCOR1NPC1RAB9A
SCHEMBL30688566 0.81 KMT2A (0.71) KDM1AMAOARCOR1ALDH1A1KMT2A
SCHEMBL2253255 0.81 ALDH1A1 (0.49) KDM1AMAOARCOR1ALDH1A1KMT2A
SCHEMBL10845805 0.81 KDM1A (0.45) KDM1AMAOARCOR1NPC1RAB9A

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
US-20200235319-A1 NEAR-INFRARED LIGHT-EMITTING DIODE AND DEVICE INCLUDING NEAR-INFRARED LIGHT-EMITTING DIODE SAMSUNG DISPLAY CO., LTD. (KR) 2020-07-23 US disclosed
EP-0460679-B1 Endothelin antagonistic peptide derivatives BANYU PHARMA CO LTD (JP) 1998-10-28 EP disclosed
US-5691315-A CARDIOVASCULAR DISORDERS; VASODILATOR; BRONCHODILATOR BANYU PHARMACEUTICAL CO., LTD. (JP) 1997-11-25 US disclosed
US-5470833-A Vasodilators, bronchodilators BANYU PHARMACEUTICAL CO., LTD. (JP) 1995-11-28 US disclosed
US-5444152-A Vasolidator or bronchodilator BANYU PHARMACEUTICAL CO., LTD. (JP) 1995-08-22 US disclosed
EP-0460679-A2 Endothelin antagonistic peptide derivatives Banyu Pharmaceutical Co., Ltd. (JP) 1991-12-11 EP 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-20200235319-A1 NEAR-INFRARED LIGHT-EMITTING DIODE AND DEVICE INCLUDING NEAR-INFRARED LIGHT-EMITTING DIODE OCIAD1, PPOX, OCIAD2 KDM1A 2185/4885MAOA 1802/4885RCOR1 510/4885

“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.