SCHEMBL19081976

SCHEMBL19081976

c1ccc2cc(-c3c4ccccc4c(-c4ccc(-c5c6oc7cc8ccccc8cc7c6cc6sc7ccccc7c56)cc4)c4ccccc34)ccc2c1

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP1A1 P04798 1/20 0.33
CYP1B1 Q16678 1/20 0.33
PTPN1 P18031 3/20 0.32
S1PR4 O95977 3/20 0.31
S1PR5 Q9H228 3/20 0.31
ESR2 Q92731 2/20 0.31
ELANE P08246 1/20 0.31
NPC1 O15118 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
RAB9A P51151 1/20 0.31
ESR1 P03372 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
SCHEMBL17945677 0.92 CYP1A2 (0.36) CYP1A1CYP1B1PTPN1S1PR4S1PR5
SCHEMBL19082064 0.91 S1PR5 (0.33) CYP1A1CYP1B1PTPN1S1PR4S1PR5
SCHEMBL19081772 0.88 ESR2 (0.36) CYP1A1PTPN1ESR2ELANECYP1A2
SCHEMBL19082025 0.85 ABCG2 (0.38) CYP1A1CYP1B1PTPN1ESR2NPC1
SCHEMBL17932261 0.84 NPC1 (0.33) CYP1A1CYP1B1S1PR4S1PR5NPC1
SCHEMBL19076727 0.84 CYP1A1 (0.33) CYP1A1CYP1B1S1PR4S1PR5ESR2
SCHEMBL19081802 0.82 CYP1A1 (0.43) CYP1A1CYP1B1CYP1A2CYP2C9CYP2C19
SCHEMBL17945674 0.81 AHR (0.36) CYP1B1PTPN1ESR2NPC1RAB9A
SCHEMBL19081844 0.81 ABCG2 (0.34) CYP1A1CYP1B1S1PR4S1PR5NPC1
SCHEMBL19081582 0.80 NPC1 (0.34) CYP1A1CYP1B1ESR2NPC1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10553800-B2 Condensed cyclic compound and an organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2020-02-04 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
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 (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-10553800-B2 Condensed cyclic compound and an organic light-emitting device including the same CRY1, CRY2, CCNT1 CYP1A1 184/4885CYP1B1 260/4885PTPN1 4695/4885
US-20170194572-A1 CONDENSED CYCLIC COMPOUND AND AN ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CRY2, CCNT1 CYP1A1 184/4885CYP1B1 260/4885PTPN1 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.