SCHEMBL21246014

SCHEMBL21246014

CCCCNC(=O)c1cnn2c(N(C)C(=O)OC(C)(C)C)cc(Cl)nc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 3/20 0.46
▸ MAPT P10636 3/20 0.46
▸ LMNA P02545 3/20 0.46
▸ CSNK1D P48730 1/20 0.39
▸ HKDC1 Q2TB90 1/20 0.37
▸ ALDH1A1 P00352 4/20 0.37
▸ HPGD P15428 3/20 0.37
▸ KDM4E B2RXH2 2/20 0.37
▸ CYP1A1 P04798 1/20 0.37
▸ CA12 O43570 1/20 0.36
▸ CA1 P00915 1/20 0.36
▸ CA2 P00918 1/20 0.36
▸ CA3 P07451 1/20 0.36
▸ CA4 P22748 1/20 0.36
▸ CA6 P23280 1/20 0.36
▸ CA5A P35218 1/20 0.36
▸ CA7 P43166 1/20 0.36
▸ CA9 Q16790 1/20 0.36
▸ CA13 Q8N1Q1 1/20 0.36
▸ CA14 Q9ULX7 1/20 0.36

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
SCHEMBL20697290 0.91 ALDH1A1 (0.41) TP53MAPTLMNACSNK1DHKDC1
SCHEMBL21246013 0.86 LMNA (0.41) TP53MAPTLMNACSNK1DHKDC1
SCHEMBL20689606 0.86 HPGD (0.36) TP53MAPTLMNACSNK1DALDH1A1
SCHEMBL20689010 0.86 TYK2 (0.44) LMNACSNK1DHPGDCYP1A1TYK2
SCHEMBL20689148 0.86 CSNK1D (0.34) TP53MAPTLMNACSNK1DHKDC1
SCHEMBL20689569 0.84 LMNA (0.41) MAPTLMNACSNK1DHKDC1ALDH1A1
SCHEMBL20688901 0.84 ALDH1A1 (0.45) ALDH1A1HPGDKDM4EPOLBTYK2
SCHEMBL20678811 0.84 KDM4E (0.41) MAPTLMNAALDH1A1HPGDKDM4E
SCHEMBL20688967 0.83 KDM4E (0.41) TP53MAPTALDH1A1HPGDKDM4E
SCHEMBL20689492 0.82 DPP4 (0.30) ALDH1A1HPGDKDM4E

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
US-10577373-B2 TYK2 inhibitors and uses thereof Nimbus Lakshimi, Inc. (US) 2020-03-03 — — US disclosed
US-10562906-B2 TYK2 inhibitors and uses thereof Nimbus Lakshimi, Inc. (US) 2020-02-18 — — US disclosed
US-20190256519-A1 TYK2 INHIBITORS AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2019-08-22 — — US disclosed
US-20190241576-A1 TYK2 INHIBITORS AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2019-08-08 — — 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 (4 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-20190256519-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 TP53 2843/4885MAPT 1236/4885LMNA 2078/4885
US-10562906-B2 TYK2 inhibitors and uses thereof TYK2, JAK2, JAK1 TP53 2843/4885MAPT 1236/4885LMNA 2078/4885
US-20190241576-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 TP53 2843/4885MAPT 1236/4885LMNA 2078/4885
US-10577373-B2 TYK2 inhibitors and uses thereof TYK2, JAK2, JAK1 TP53 2843/4885MAPT 1236/4885LMNA 2078/4885

“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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