SCHEMBL19980374

SCHEMBL19980374

c1ccc2c(c1)-c1ccccc1C21c2ccccc2-c2cc3[nH]c4ccccc4c3c3cccc1c23

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.41
LMNA P02545 2/20 0.41
HTT P42858 2/20 0.41
IMPDH2 P12268 1/20 0.40
IMPDH1 P20839 1/20 0.40
PARP1 P09874 3/20 0.38
ALDH1A1 P00352 2/20 0.38
GPR3 P46089 1/20 0.38
HSD17B10 Q99714 1/20 0.38
CDK4 P11802 3/20 0.38
CCND1 P24385 3/20 0.38
AHR P35869 2/20 0.38
MAP3K9 P80192 1/20 0.36
MAP3K11 Q16584 1/20 0.36
MEN1 O00255 2/20 0.36
MAPT P10636 2/20 0.36
KMT2A Q03164 2/20 0.36
GABRP O00591 1/20 0.36
GABRD O14764 1/20 0.36
GABRA1 P14867 1/20 0.36

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
SCHEMBL19980552 0.89 CDK4 (0.44) KDM4ELMNAHTTPARP1ALDH1A1
SCHEMBL19980433 0.86 KDM4E (0.39) KDM4ELMNAHTTIMPDH2IMPDH1
SCHEMBL19980551 0.86 KDM4E (0.36) KDM4ELMNAHTTPARP1CDK4
SCHEMBL5038338 0.82 IMPDH2 (0.50) KDM4ELMNAHTTIMPDH2IMPDH1
SCHEMBL19980580 0.81 KIF11 (0.40) KDM4ELMNAHTTALDH1A1KIF11
SCHEMBL17368356 0.81 PARP1 (0.36) KDM4ELMNAHTTIMPDH2IMPDH1
SCHEMBL12490627 0.80 ALDH1A1 (0.48) KDM4ELMNAHTTIMPDH2IMPDH1
SCHEMBL21303002 0.80 ALDH1A1 (0.48) KDM4ELMNAHTTIMPDH2IMPDH1
Carbazole SCHEMBL1810585 0.80 ALDH1A1 (0.61) KDM4ELMNAHTTPARP1ALDH1A1
SCHEMBL2603653 0.76 AHR (0.55) KDM4EALDH1A1GPR3HSD17B10AHR

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-3512841-B1 COMPOUNDS WITH SPIROBIFLUORENE-STRUCTURES MERCK PATENT GMBH (DE) 2023-04-26 EP disclosed
US-11447464-B2 Compounds with spirobifluorene-structures MERCK PATENT GMBH (DE) 2022-09-20 US disclosed
US-20190194164-A1 COMPOUNDS WITH SPIROBIFLUORENE-STRUCTURES MERCK PATENT GMBH (DE) 2019-06-27 US disclosed
WO-2018050584-A1 COMPOUNDS WITH SPIROBIFLUORENE-STRUCTURES MERCK PATENT GMBH (DE) 2018-03-22 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 (2 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-11447464-B2 Compounds with spirobifluorene-structures SLCO1B3, SLCO4C1, SLCO1B1 KDM4E 4250/4885LMNA 2809/4885HTT 275/4885
US-20190194164-A1 COMPOUNDS WITH SPIROBIFLUORENE-STRUCTURES SLCO1B3, SLCO4C1, SLCO1B1 KDM4E 4250/4885LMNA 2809/4885HTT 275/4885

“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.