SCHEMBL12401763

SCHEMBL12401763

Cc1cc(Cl)cc(C(C)(C)C)c1C

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 4/20 0.37
▸ CYP2C9 P11712 2/20 0.37
▸ CYP2C19 P33261 2/20 0.37
▸ TP53 P04637 2/20 0.37
▸ HIF1A Q16665 2/20 0.37
▸ CYP1A2 P05177 2/20 0.35
▸ ALDH1A1 P00352 3/20 0.34
▸ POLB P06746 3/20 0.34
▸ CA2 P00918 2/20 0.34
▸ TYR P14679 1/20 0.34
▸ ALOX15 P16050 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ ATP2A2 P16615 1/20 0.33
▸ ATP2A3 Q93084 1/20 0.33
▸ SCN4A P35499 2/20 0.32
▸ TSHR P16473 2/20 0.32
▸ RAPGEF4 Q8WZA2 1/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ MAPK1 P28482 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
SCHEMBL47589 0.87 SMN1; SMN2 (0.41) SMN1; SMN2CYP2C9CYP2C19TP53HIF1A
SCHEMBL25950739 0.81 ALOX15 (0.37) SMN1; SMN2CYP2C9CYP2C19TP53HIF1A
SCHEMBL10824242 0.81 SMN1; SMN2 (0.46) SMN1; SMN2CYP2C9CYP2C19TP53HIF1A
SCHEMBL13550053 0.79 TMPRSS4 (0.36) SMN1; SMN2CYP2C19TP53CYP1A2MAPT
SCHEMBL7034392 0.77 CYP2C9 (0.63) SMN1; SMN2CYP2C9CYP2C19TP53HIF1A
SCHEMBL8975178 0.76 TSHR (0.47) TP53ALDH1A1ALOX15SCN4ATSHR
SCHEMBL21265843 0.75 SMN1; SMN2 (0.54) SMN1; SMN2CYP2C9CYP2C19TP53HIF1A
SCHEMBL27489164 0.75 POLB (0.48) SMN1; SMN2CYP2C9CYP2C19TP53HIF1A
SCHEMBL12401834 0.74 MAP3K14 (0.41) SMN1; SMN2TP53ALDH1A1CA2ALOX15
SCHEMBL14498955 0.72 MAP3K14 (0.42) CYP2C9CYP2C19CYP1A2ALDH1A1POLB

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-12030853-B2 MASP-2 inhibitors and methods of use OMEROS CORPORATION (US) 2024-07-09 — — US disclosed
US-11807641-B2 MASP-2 inhibitors and methods of use OMEROS CORPORATION (US) 2023-11-07 — — US disclosed
US-11661418-B2 MASP-2 inhibitors and methods of use OMEROS CORPORATION (US) 2023-05-30 — — US disclosed
US-20230145071-A1 MASP-2 INHIBITORS AND METHODS OF USE OMEROS CORPORATION 2023-05-11 — — US disclosed
US-10040804-B2 Compounds targeting proteins, compositions, methods, and uses thereof BIOTHERYX, INC. (US) 2018-08-07 — — US disclosed
US-10040804-B2 Compounds targeting proteins, compositions, methods, and uses thereof BIOTHERYX, INC. (US) 2018-08-07 — — US disclosed
US-8372873-B2 Inhibitors of serine proteases VERTEX PHARMACEUTICALS INCORPORATED (US) 2013-02-12 — — US disclosed
US-20110182856-A1 INHIBITORS OF SERINE PROTEASES VERTEX PHARMACEUTICALS INCORPORATED (US) 2011-07-28 — — US disclosed
US-7964624-B1 Inhibitors of serine proteases VERTEX PHARMACEUTICALS INCORPORATED (US) 2011-06-21 — — 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 (6 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-11807641-B2 MASP-2 inhibitors and methods of use MASP2, METAP2, SPINT2 SMN1; SMN2 1476/4885CYP2C9 4847/4885CYP2C19 4866/4885
US-20230145071-A1 MASP-2 INHIBITORS AND METHODS OF USE MASP2, METAP2, SPINT2 SMN1; SMN2 1519/4885CYP2C9 4844/4885CYP2C19 4866/4885
US-10040804-B2 Compounds targeting proteins, compositions, methods, and uses thereof CKS1B, IKZF3, EPAS1 SMN1; SMN2 2944/4885CYP2C9 4379/4885CYP2C19 4570/4885
US-20110182856-A1 INHIBITORS OF SERINE PROTEASES PRSS1, SPINT2, PRSS2 SMN1; SMN2 2156/4885CYP2C9 1014/4885CYP2C19 1096/4885
US-12030853-B2 MASP-2 inhibitors and methods of use MASP2, METAP2, SPINT2 SMN1; SMN2 1476/4885CYP2C9 4847/4885CYP2C19 4866/4885
US-11661418-B2 MASP-2 inhibitors and methods of use MASP2, METAP2, SPINT2 SMN1; SMN2 1476/4885CYP2C9 4847/4885CYP2C19 4866/4885

“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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