SCHEMBL21274472

SCHEMBL21274472

COCC1CCCN1CCn1ccc2ccc(N3CCN(c4ccccc4C)CC3)nc21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ VEGFA P15692 1/20 0.37
▸ EGLN1 Q9GZT9 1/20 0.37
▸ PDE10A Q9Y233 1/20 0.37
▸ DRD2 P14416 2/20 0.36
▸ HTR2A P28223 2/20 0.36
▸ HTR2C P28335 2/20 0.36
▸ SPHK2 Q9NRA0 1/20 0.36
▸ SPHK1 Q9NYA1 1/20 0.36
▸ MCHR1 Q99705 2/20 0.35
▸ KCNH2 Q12809 1/20 0.35
▸ MCHR2 Q969V1 1/20 0.34
▸ NPC1 O15118 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ NTSR1 P30989 1/20 0.34
▸ TLR7 Q9NYK1 1/20 0.34
▸ SLC18A3 Q16572 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ CXCR4 P61073 1/20 0.33
▸ HTR6 P50406 2/20 0.33
▸ HTR1D P28221 1/20 0.33

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
SCHEMBL21285601 0.86 SPHK2 (0.36) VEGFAEGLN1PDE10ADRD2HTR2A
SCHEMBL21281450 0.86 HRH3 (0.42) KCNH2SLC18A3
SCHEMBL21274100 0.86 HRH3 (0.42) KCNH2SLC18A3
SCHEMBL21268806 0.86 HRH3 (0.42) KCNH2SLC18A3
SCHEMBL21274178 0.81 SLC18A3 (0.35) HTR2AHTR2CSLC18A3KMT2ACXCR4
SCHEMBL21274058 0.80 SLC18A3 (0.36) DRD2KCNH2NPC1RAB9ASLC18A3
SCHEMBL21274394 0.80 NPC1 (0.37) DRD2HTR2AHTR2CNPC1RAB9A
SCHEMBL21274036 0.80 NPC1 (0.35) MCHR1KCNH2NPC1RAB9ANTSR1
SCHEMBL21281500 0.79 ADRA1A (0.45) DRD2HTR2AHTR2CHTR1B
SCHEMBL21285495 0.77 PARP1 (0.42) DRD2NPC1RAB9AKMT2ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200399268-A1 Pharmaceutical 6,5 Heterobicyclic Ring Derivatives EVOTEC (UK) LTD (GB) 2020-12-24 — — US claimed
EP-3752150-A1 PHARMACEUTICAL 6,5 HETEROBICYCLIC RING DERIVATIVES UCB Biopharma SRL (BE) 2020-12-23 — — EP claimed
CN-112105357-A Pharmaceutically acceptable 6,5 heterobicyclic derivatives UCB生物制药有限责任公司 2020-12-18 — — CN claimed
WO-2019158731-A1 PHARMACEUTICAL 6,5 HETEROBICYCLIC RING DERIVATIVES UCB BIOPHARMA SPRL (BE) 2019-08-22 — — WO claimed
US-20200399268-A1 Pharmaceutical 6,5 Heterobicyclic Ring Derivatives EVOTEC (UK) LTD (GB) 2020-12-24 — — US disclosed
US-20200399268-A1 Pharmaceutical 6,5 Heterobicyclic Ring Derivatives EVOTEC (UK) LTD (GB) 2020-12-24 — — US disclosed
EP-3752150-A1 PHARMACEUTICAL 6,5 HETEROBICYCLIC RING DERIVATIVES UCB Biopharma SRL (BE) 2020-12-23 — — EP disclosed
CN-112105357-A Pharmaceutically acceptable 6,5 heterobicyclic derivatives UCB生物制药有限责任公司 2020-12-18 — — CN disclosed
WO-2019158731-A1 PHARMACEUTICAL 6,5 HETEROBICYCLIC RING DERIVATIVES UCB BIOPHARMA SPRL (BE) 2019-08-22 — — 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 (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-20200399268-A1 Pharmaceutical 6,5 Heterobicyclic Ring Derivatives STING1, IRF3, NFATC1 VEGFA 1667/4885EGLN1 3435/4885PDE10A 243/4885

“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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