SCHEMBL19082329

SCHEMBL19082329

c1ccc(-c2c3ccccc3c(-c3ccc(-c4cc5sc6ccccc6c5c5c4sc4cc6ccccc6cc45)c4ccccc34)c3ccccc23)cc1

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 3/20 0.35
ESR2 Q92731 3/20 0.35
PTPN1 P18031 3/20 0.34
CHEK1 O14757 1/20 0.34
WEE1 P30291 1/20 0.34
TNKS O95271 1/20 0.32
TNKS2 Q9H2K2 1/20 0.32
PTPRC P08575 1/20 0.31
PTPRF P10586 1/20 0.31
PTPRA P18433 1/20 0.31
PTPRB P23467 1/20 0.31
PTPN6 P29350 1/20 0.31
DUSP3 P51452 1/20 0.31
PTPN12 Q05209 1/20 0.31
MAOA P21397 1/20 0.30
MAOB P27338 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
SCHEMBL19082096 0.94 ESR1 (0.38) ESR1ESR2PTPN1CHEK1WEE1
SCHEMBL17944221 0.92 PTPN1 (0.39) PTPN1CHEK1WEE1TNKSTNKS2
SCHEMBL19082364 0.89 PTPN1 (0.32) PTPN1MAOAMAOB
SCHEMBL19082234 0.88 ESR1 (0.35) ESR1ESR2PTPN1CHEK1WEE1
SCHEMBL19082332 0.87 TNKS (0.37) ESR1ESR2PTPN1TNKSTNKS2
SCHEMBL19080309 0.85 ESR1 (0.40) ESR1ESR2PTPN1CHEK1WEE1
SCHEMBL17932262 0.85 PTPN1 (0.41) PTPN1CHEK1WEE1TNKSTNKS2
SCHEMBL19082189 0.85 CHEK1 (0.37) ESR1ESR2PTPN1CHEK1WEE1
SCHEMBL19082331 0.85 PTPN1 (0.36) ESR1ESR2PTPN1CHEK1WEE1
SCHEMBL19082118 0.84 PTPN1 (0.33) PTPN1TNKSTNKS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170194572-A1 CONDENSED CYCLIC COMPOUND AND AN ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2017-07-06 US disclosed
US-20170194572-A1 CONDENSED CYCLIC COMPOUND AND AN ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2017-07-06 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-20170194572-A1 CONDENSED CYCLIC COMPOUND AND AN ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CRY2, CCNT1 ESR1 225/4885ESR2 542/4885PTPN1 4695/4885

“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.