SCHEMBL22802033

SCHEMBL22802033

CC(=O)c1ccc(N2CCN(c3ccc4c(C#N)cn([C@@H]5CCNC[C@H]5F)c4n3)CC2)cc1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ MEN1 O00255 5/20 0.37
▸ KMT2A Q03164 5/20 0.37
▸ TP53 P04637 2/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ TBK1 Q9UHD2 2/20 0.34
▸ NPC1 O15118 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ RET P07949 2/20 0.34
▸ RXFP1 Q9HBX9 1/20 0.33
▸ BCL9 O00512 1/20 0.33
▸ CDH1 P12830 1/20 0.33
▸ CTNNB1 P35222 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
SCHEMBL21274363 0.89 KMT2A (0.39) MAPTSMN1; SMN2MEN1KMT2ATP53
SCHEMBL21274288 0.89 KMT2A (0.39) MAPTSMN1; SMN2MEN1KMT2ATP53
SCHEMBL21274056 0.87 KMT2A (0.40) MAPTSMN1; SMN2MEN1KMT2ATP53
SCHEMBL22822815 0.82 TP53 (0.38) MAPTSMN1; SMN2MEN1KMT2ATP53
SCHEMBL21274083 0.81 MEN1 (0.40) MAPTSMN1; SMN2MEN1KMT2ATP53
SCHEMBL21274187 0.79 MAPT (0.40) MAPTSMN1; SMN2MEN1KMT2ATP53
SCHEMBL21273856 0.79 MAPT (0.40) MAPTSMN1; SMN2MEN1KMT2ATP53
SCHEMBL21268734 0.78 MAPT (0.39) MAPTSMN1; SMN2MEN1KMT2ATP53
SCHEMBL21268737 0.78 MAPT (0.39) MAPTSMN1; SMN2MEN1KMT2ATP53
SCHEMBL21281509 0.78 MAPT (0.39) MAPTSMN1; SMN2MEN1KMT2ATP53

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
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
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
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

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 MAPT 2459/4885SMN1; SMN2 2435/4885MEN1 3236/4885

“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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