SCHEMBL7863462

SCHEMBL7863462

Cc1nc2cccc3n(CCCCN4C(=O)c5ccccc5C4=O)c(=O)c1n23

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
ALDH1A1 P00352 3/20 0.43
HPGD P15428 2/20 0.43
GAA P10253 1/20 0.43
USP2 O75604 1/20 0.43
TSHR P16473 1/20 0.43
KDM4E B2RXH2 1/20 0.41
HEXA P06865 1/20 0.40
HEXB P07686 1/20 0.40
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
NR1I2 O75469 1/20 0.39
POLB P06746 1/20 0.39
AHR P35869 1/20 0.39
RAD52 P43351 1/20 0.39
RCE1 Q9Y256 1/20 0.39

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
SCHEMBL7870352 0.99 ALDH1A1 (0.45) KMT2ASMN1; SMN2ALDH1A1HPGDGAA
SCHEMBL7863477 0.99 ALDH1A1 (0.45) KMT2ASMN1; SMN2ALDH1A1HPGDGAA
SCHEMBL7870359 0.98 KMT2A (0.47) KMT2ASMN1; SMN2ALDH1A1HPGDGAA
SCHEMBL7871561 0.87 ALDH1A1 (0.36) KMT2ASMN1; SMN2ALDH1A1HPGDGAA
SCHEMBL7863478 0.79 ALDH1A1 (0.48) KMT2ASMN1; SMN2ALDH1A1HPGDGAA
Hydrochloric Acid SCHEMBL7871692 0.76 MEN1 (0.37) KMT2AALDH1A1TDP1
Hydrochloric Acid SCHEMBL7871546 0.76 TDP1 (0.41) ALDH1A1TDP1POLB
SCHEMBL7872436 0.76 ALDH1A1 (0.44) SMN1; SMN2ALDH1A1GAATSHRKDM4E
SCHEMBL7875380 0.76 HTR1A (0.48) KMT2ASMN1; SMN2ALDH1A1GAAPOLB
SCHEMBL7868808 0.76 HSD17B10 (0.50) KMT2AALDH1A1HPGDGAATSHR

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
US-20010051631-A1 Tricyclic compounds, their production and use TAKATANI MUNEO (JP) 2001-12-13 US disclosed
US-6251905-B1 Tricyclic compounds, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-06-26 US disclosed
EP-0771319-A1 TRICYCLIC COMPOUNDS, THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 1997-05-07 EP disclosed
WO-1996002542-A1 TRICYCLIC COMPOUNDS, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-02-01 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-20010051631-A1 Tricyclic compounds, their production and use PDGFA, HGF, REN KMT2A 971/4885SMN1; SMN2 4706/4885ALDH1A1 2398/4885

“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.