SCHEMBL19788892

SCHEMBL19788892

Cn1nc(NC(=O)CN2CCCC2)c2c(Cl)ccc(C(C)(C)C)c21

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 2/20 0.44
▸ ALDH1A1 P00352 3/20 0.43
▸ TSHR P16473 1/20 0.43
▸ SIGMAR1 Q99720 1/20 0.42
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ ATM Q13315 1/20 0.41
▸ NPC1 O15118 2/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39

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
SCHEMBL16006435 0.86 MEN1 (0.48) HPGDALDH1A1TSHRSIGMAR1MEN1
SCHEMBL19788836 0.84 ALDH1A1 (0.35) HPGDALDH1A1TSHRSIGMAR1MEN1
SCHEMBL19788770 0.84 CYP3A4 (0.39) HPGDALDH1A1TSHRMEN1KMT2A
SCHEMBL19788828 0.84 KDM4E (0.36) ALDH1A1MEN1KMT2AATMNPC1
SCHEMBL19788894 0.83 SMN1; SMN2 (0.36) ALDH1A1KDM4E
SCHEMBL20079062 0.83 MEN1 (0.50) HPGDALDH1A1TSHRSIGMAR1MEN1
SCHEMBL19788771 0.81 ALDH1A1 (0.34) ALDH1A1NPC1KDM4E
SCHEMBL19788831 0.81 HTT (0.40) HPGDALDH1A1NPC1RAB9AKDM4E
SCHEMBL19788826 0.81 KDM4E (0.41) ALDH1A1MEN1KMT2ANPC1RAB9A
SCHEMBL20079064 0.81 ALDH1A1 (0.41) ALDH1A1MEN1KMT2ANPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230312567-A1 CAPSID INHIBITORS FOR THE TREATMENT OF HIV GILEAD SCIENCES, INC. 2023-10-05 — — US disclosed
US-11680064-B2 Capsid inhibitors for the treatment of HIV GILEAD SCIENCES, INC. (US) 2023-06-20 — — US disclosed
US-20230038823-A1 CAPSID INHIBITORS FOR THE TREATMENT OF HIV GILEAD SCIENCES, INC. (US) 2023-02-09 — — US disclosed
US-20210009555-A1 THERAPEUTIC COMPOUNDS GILEAD SCIENCES, INC. 2021-01-14 — — US disclosed
US-9951043-B2 Therapeutic compounds GILEAD SCIENCES, INC. (US) 2018-04-24 — — US disclosed
US-9873680-B2 Therapeutic compounds GILEAD SCIENCES, INC. (US) 2018-01-23 — — 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-20230312567-A1 CAPSID INHIBITORS FOR THE TREATMENT OF HIV HAVCR2, MAVS, CD4 HPGD 1802/4885ALDH1A1 3650/4885TSHR 4881/4885
US-20210009555-A1 THERAPEUTIC COMPOUNDS HAVCR2, SARS1, RPL35 HPGD 850/4885ALDH1A1 351/4885TSHR 4738/4885
US-20230038823-A1 CAPSID INHIBITORS FOR THE TREATMENT OF HIV HAVCR2, MAVS, CD4 HPGD 1802/4885ALDH1A1 3650/4885TSHR 4881/4885
US-11680064-B2 Capsid inhibitors for the treatment of HIV HAVCR2, MAVS, CD4 HPGD 1802/4885ALDH1A1 3650/4885TSHR 4881/4885

“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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