SCHEMBL22062340

SCHEMBL22062340

Ic1ccc2c(c1)ncc1c3ccccc3ccc21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.47
GPR3 P46089 1/20 0.47
HPRT1 P00492 4/20 0.47
MAPT P10636 3/20 0.46
LMNA P02545 2/20 0.46
NPC1 O15118 1/20 0.46
RECQL P46063 1/20 0.46
RAB9A P51151 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
CYP3A4 P08684 2/20 0.44
APEX1 P27695 1/20 0.41
MAPK1 P28482 1/20 0.41
PMP22 Q01453 1/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
ALDH1A1 P00352 3/20 0.40
HSD17B10 Q99714 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
CYP2A6 P11509 1/20 0.40
TSHR P16473 1/20 0.40

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
SCHEMBL29827472 0.82 GPR3 (0.69) KDM4EGPR3HPRT1MAPTLMNA
SCHEMBL241476 0.82 GPR3 (0.69) KDM4EGPR3HPRT1MAPTLMNA
SCHEMBL27331369 0.80 KDM4E (0.47) KDM4EGPR3HPRT1MAPTLMNA
SCHEMBL20653082 0.80 KDM4E (0.52) KDM4EGPR3HPRT1MAPTLMNA
SCHEMBL8156316 0.78 KDM4E (0.42) KDM4EGPR3MAPTALDH1A1HTT
SCHEMBL23783950 0.78 HPRT1 (0.64) HPRT1MAPTLMNACYP3A4APEX1
SCHEMBL19558294 0.78 HPRT1 (0.64) HPRT1MAPTLMNACYP3A4APEX1
SCHEMBL1527553 0.76 ALDH1A1 (0.61) HPRT1MAPTALDH1A1HSD17B10TDP1
SCHEMBL20019436 0.74 GPR3 (0.62) KDM4EGPR3CYP3A4MEN1KMT2A
SCHEMBL16755458 0.73 ALDH1A1 (0.64) HPRT1MAPTCYP3A4ALDH1A1HSD17B10

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10680182-B2 Fluoranthene compound, and organic electronic device comprising same LG CHEM, LTD. (KR) 2020-06-09 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-10680182-B2 Fluoranthene compound, and organic electronic device comprising same AFF2, ESR1, AFF4 KDM4E 870/4885GPR3 4341/4885HPRT1 1698/4885

“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.