SCHEMBL13556941

SCHEMBL13556941

Cc1ccc2c(c1)sc1cc3cc4cc(C)sc4cc3cc12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BCL2L1 Q07817 1/20 0.36
▸ MCL1 Q07820 1/20 0.36
▸ RAB9A P51151 3/20 0.34
▸ MAPT P10636 2/20 0.34
▸ HDAC3 O15379 1/20 0.34
▸ HDAC4 P56524 1/20 0.34
▸ HDAC1 Q13547 1/20 0.34
▸ HDAC7 Q8WUI4 1/20 0.34
▸ HDAC2 Q92769 1/20 0.34
▸ HDAC10 Q969S8 1/20 0.34
▸ HDAC11 Q96DB2 1/20 0.34
▸ HDAC8 Q9BY41 1/20 0.34
▸ HDAC6 Q9UBN7 1/20 0.34
▸ HDAC9 Q9UKV0 1/20 0.34
▸ HDAC5 Q9UQL6 1/20 0.34
▸ CYP2A6 P11509 3/20 0.33
▸ CYP1A2 P05177 3/20 0.33
▸ LMNA P02545 2/20 0.32
▸ NPC1 O15118 2/20 0.32
▸ GAA P10253 1/20 0.32

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
SCHEMBL12797473 1.00 BCL2L1 (0.36) BCL2L1MCL1RAB9AMAPTHDAC3
SCHEMBL12796847 0.93 BCL2L1 (0.38) BCL2L1MCL1RAB9AMAPTHDAC3
SCHEMBL12796846 0.93 BCL2L1 (0.38) BCL2L1MCL1RAB9AMAPTHDAC3
SCHEMBL12797476 0.89 BCL2L1 (0.42) BCL2L1MCL1RAB9AMAPTHDAC3
SCHEMBL23567606 0.88 BCL2L1 (0.43) BCL2L1MCL1RAB9AMAPTHDAC3
SCHEMBL12797452 0.88 BCL2L1 (0.43) BCL2L1MCL1RAB9AMAPTHDAC3
SCHEMBL19061829 0.86 ALDH1A1 (0.33) ALDH1A1
SCHEMBL13556946 0.84 ALDH1A1 (0.34) ALDH1A1
SCHEMBL12797485 0.83 CYP2A6 (0.36) BCL2L1MCL1HDAC3HDAC4HDAC1
SCHEMBL12433613 0.82 CYP2A6 (0.50) BCL2L1MCL1RAB9AMAPTHDAC3

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-2483367-B1 ELECTROLUMINESCENT THIOPHENE DERIVATIVES LOMOX LTD (GB) 2015-09-16 — — EP disclosed
US-9006435-B2 Electroluminescent thiophene derivatives LOMOX LIMITED (GB) 2015-04-14 — — US disclosed
US-9006435-B2 Electroluminescent thiophene derivatives LOMOX LIMITED (GB) 2015-04-14 — — US disclosed
US-20120271052-A1 ELECTROLUMINESCENT THIOPHENE DERIVATIVES LOMOX LIMITED (GB) 2012-10-25 — — 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-20120271052-A1 ELECTROLUMINESCENT THIOPHENE DERIVATIVES AR, NR2E3, NES BCL2L1 1302/4885MCL1 4238/4885RAB9A 1560/4885

“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.

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