SCHEMBL98001

SCHEMBL98001

CCC(=O)Nc1cc[c]cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.56
MAPT P10636 2/20 0.56
ATM Q13315 1/20 0.56
SMN1; SMN2 Q16637 3/20 0.55
RAB9A P51151 4/20 0.53
ALDH1A1 P00352 2/20 0.53
HPGD P15428 1/20 0.53
CA12 O43570 1/20 0.53
CA1 P00915 1/20 0.53
CA2 P00918 1/20 0.53
CA9 Q16790 1/20 0.53
POLB P06746 2/20 0.50
NR4A1 P22736 1/20 0.50
CYP3A4 P08684 1/20 0.50
KDM4E B2RXH2 1/20 0.50
KMT2A Q03164 3/20 0.49
MEN1 O00255 2/20 0.49
HTT P42858 1/20 0.49
CACNA1B Q00975 1/20 0.47
APBA1 Q02410 1/20 0.47

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
SCHEMBL9409003 0.89 TP53 (0.58) GAAMAPTATMSMN1; SMN2RAB9A
SCHEMBL13989319 0.84 GAA (0.73) GAAMAPTATMSMN1; SMN2RAB9A
SCHEMBL145468 0.84 TP53 (0.67) MAPTSMN1; SMN2RAB9AALDH1A1HPGD
SCHEMBL4133285 0.81 ALDH1A1 (0.58) SMN1; SMN2RAB9AALDH1A1HPGDCA12
SCHEMBL196368 0.81 MEN1 (0.42) GAAMAPTRAB9AALDH1A1HPGD
Water SCHEMBL27398863 0.81 GAA (0.81) GAAMAPTATMSMN1; SMN2RAB9A
SCHEMBL10962729 0.80 HPGD (0.62) GAAMAPTSMN1; SMN2RAB9AHPGD
SCHEMBL8118546 0.80 CA1 (0.56) GAAMAPTALDH1A1HPGDCA1
SCHEMBL4629132 0.80 GAA (0.49) GAAMAPTATMSMN1; SMN2RAB9A
SCHEMBL6342401 0.80 ALDH1A1 (0.59) SMN1; SMN2RAB9AALDH1A1HPGDPOLB

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 661 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024146922-A1 C5AR1 INHIBITORS FOR USE IN THE TREATMENT OF OCULAR MUCOUS MEMBRANE PEMPHIGOID AND/OR ORAL MUCOUS MEMBRANE PEMPHIGOID DOMPE' FARMACEUTICI SPA (IT) 2024-07-11 WO claimed
EP-4397306-A1 C5AR1 INHIBITORS FOR USE IN THE TREATMENT OF OCULAR MUCOUS MEMBRANE PEMPHIGOID AND/OR ORAL MUCOUS MEMBRANE PEMPHIGOID Dompe' Farmaceutici S.P.A. (IT) 2024-07-10 EP claimed
US-20240180888-A1 C5AR1 INHIBITORS FOR TREATING HYPERSENSITIVITY REACTIONS TO TAXANES DOMPE' FARMACEUTICI SPA (IT) 2024-06-06 US claimed
EP-4308114-A1 C5AR1 INHIBITORS FOR TREATING HYPERSENSITIVITY REACTIONS TO TAXANES Dompe' Farmaceutici SpA (IT) 2024-01-24 EP claimed
CN-117337176-A C5AR1 inhibitors for treating hypersensitivity to taxanes 东佩制药股份公司 2024-01-02 CN claimed
US-20230201178-A1 PROLYL HYDROXYLASE INHIBITORS AND METHODS OF USE KREOS CAPITAL VII (UK) LIMITED (GB) 2023-06-29 US claimed
US-20210137901-A1 PROLYL HYDROXYLASE INHIBITORS AND METHODS OF USE KREOS CAPITAL VII (UK) LIMITED (GB) 2021-05-13 US claimed
US-20200397725-A1 C5AR INHIBITORS FOR USE IN THE TREATMENT OF CHEMOTHERAPY-INDUCED IATROGENIC PAIN DOMPE' FARMACEUTICI S.P.A. (IT) 2020-12-24 US claimed
EP-3723744-A2 C5AR INHIBITORS FOR USE IN THE TREATMENT OF CHEMOTHERAPY-INDUCED IATROGENIC PAIN Dompé farmaceutici S.p.A. (IT) 2020-10-21 EP claimed
CN-111511363-A C5aR inhibitors for the treatment of chemotherapy-induced iatrogenic pain 多姆皮制药公司 2020-08-07 CN claimed
CN-1200114-A Quinoline derivatives as GNRH antagonists TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1998-11-25 CN claimed
EP-0876349-A1 QUINOLINE DERIVATIVES AS GNRH ANTAGONISTS Takeda Chemical Industries, Ltd. (JP) 1998-11-11 EP claimed
US-5807869-A Quinoline derivatives, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-09-15 US claimed
WO-1997014682-A1 QUINOLINE DERIVATIVES AS GNRH ANTAGONISTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1997-04-24 WO claimed
EP-0387201-B1 Mixture of dyestuffs and their use CIBA GEIGY AG (CH) 1994-02-02 EP claimed
US-5131919-A Trichromic dyeing or printing CIBA-GEIGY CORPORATION (US) 1992-07-21 US claimed
EP-0387201-A1 Mixture of dyestuffs and their use CIBA-GEIGY AG (CH) 1990-09-12 EP claimed
US-4716168-A STIMULANTS OF IMMUNE RESPONSE NORWICH EATON PHARMACEUTICALS, INC. (US) 1987-12-29 US claimed
EP-0187705-A2 Imidazo(4,5-f)quinolines useful as immunomodulating agents Norwich Eaton Pharmaceuticals, Inc. (US) 1986-07-16 EP claimed
US-4262851-A HIGH SPEED MILLING WITHOUT SURFACTANTS BASF AKTIENGESELLSCHAFT (DE) 1981-04-21 US claimed

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-20240180888-A1 C5AR1 INHIBITORS FOR TREATING HYPERSENSITIVITY REACTIONS TO TAXANES C5AR1, C5AR2, C3AR1 GAA 4565/4885MAPT 3127/4885ATM 1287/4885
US-20210137901-A1 PROLYL HYDROXYLASE INHIBITORS AND METHODS OF USE HIF1AN, EGLN3, HIF1A GAA 139/4885MAPT 4669/4885ATM 3654/4885
US-20230201178-A1 PROLYL HYDROXYLASE INHIBITORS AND METHODS OF USE HIF1AN, EGLN3, HIF1A GAA 139/4885MAPT 4669/4885ATM 3654/4885
US-20200397725-A1 C5AR INHIBITORS FOR USE IN THE TREATMENT OF CHEMOTHERAPY-INDUCED IATROGENIC PAIN C5AR2, C5AR1, C3AR1 GAA 4834/4885MAPT 4697/4885ATM 2786/4885

“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.