SCHEMBL1997318

SCHEMBL1997318

CC(C)C(C(C)C)C(N)N

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.33
TSHR P16473 1/20 0.33
HSD17B10 Q99714 1/20 0.33
SLC7A5 Q01650 1/20 0.30

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
SCHEMBL14885531 0.87 ALDH1A1 (0.31) ALDH1A1TSHRHSD17B10
SCHEMBL537196 0.75
SCHEMBL13244491 0.73 ALDH1A1 (0.33) ALDH1A1TSHRHSD17B10SLC7A5
SCHEMBL2370082 0.73 ALDH1A1 (0.33) ALDH1A1TSHRHSD17B10SLC7A5
SCHEMBL18674361 0.73 ALDH1A1 (0.33) ALDH1A1TSHRHSD17B10SLC7A5
Hydrochloric Acid SCHEMBL28864197 0.70
Hydrochloric Acid SCHEMBL27565551 0.70
SCHEMBL2633201 0.68
SCHEMBL11664834 0.68
SCHEMBL597106 0.68 ALDH1A1 (0.50) ALDH1A1TSHRHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240109915-A1 NOVEL ACC INHIBITORS PFIZER INC. (US) 2024-04-04 US disclosed
US-20240083906-A1 COMPOUNDS AND METHODS FOR INHIBITING MITOTIC PROGRESSION MILLENNIUM PHARM INC (US) 2024-03-14 US disclosed
WO-2024026359-A1 COMPOUNDS AND METHODS FOR THE TREATMENT OF DISEASES ASSOCIATED WITH PARASITIC WORMS THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2024-02-01 WO disclosed
EP-4007753-A1 KIF18A INHIBITORS Amgen Inc. (US) 2022-06-08 EP disclosed
EP-4007638-A1 PYRIDINE DERIVATIVES AS KIF18A INHIBITORS Amgen Inc. (US) 2022-06-08 EP disclosed
WO-2022038617-A1 HOT MELT ADHESIVE ARTICLES MATZA SAGI (IL) 2022-02-24 WO disclosed
WO-2021255681-A1 A SIMPLE PROCESS FOR THE PREPARATION OF FAVIPIRAVIR AND ITS INTERMEDIATES THEREOF HIKAL LIMITED (IN) 2021-12-23 WO disclosed
US-11014928-B2 Compounds and methods for inhibiting mitotic progression MILLENNIUM PHARMACEUTICALS, INC. (US) 2021-05-25 US disclosed
WO-2021026099-A1 KIF18A INHIBITORS AMGEN INC. (US) 2021-02-11 WO disclosed
WO-2021026100-A1 PYRIDINE DERIVATIVES AS KIF18A INHIBITORS AMGEN INC. (US) 2021-02-11 WO disclosed
US-20050256102-A1 Compounds and methods for inhibiting mitotic progression MILLENNIUM PHARMACEUTICALS, INC. (US) 2005-11-17 US disclosed
WO-2005082430-A1 BIOMATERIALS FOR ENHANCED HEALING BOSTON SCIENTIFIC LIMITED (INCORPORATED IN IRELAND) (BB) 2005-09-09 WO disclosed
US-20050171105-A1 For therapy of benign and malignant proliferative disorders as well as diseases resulting from inappropriate activation of the immune and nervous systems IRM LLC (BM) 2005-08-04 US disclosed
US-6881743-B2 Pyridine matrix metalloproteinase inhibitors WARNER-LAMBERT COMPANY (US) 2005-04-19 US disclosed
WO-2005033086-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2005-04-14 WO disclosed
US-20040209922-A1 Pyridine matrix metalloproteinase inhibitors BARVIAN NICOLE CHANTEL (US) 2004-10-21 US disclosed
EP-1362033-A1 PYRIDINE MATRIX METALLOPROTEINASE INHIBITORS Warner-Lambert Company LLC (US) 2003-11-19 EP disclosed
US-20020161000-A1 Pyridine matrix metalloproteinase inhibitors WARNER-LAMBERT COMPANY 2002-10-31 US disclosed
WO-2002064568-A1 PYRIDINE MATRIX METALLOPROTEINASE INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2002-08-22 WO disclosed
US-5602141-A WATER SOLUBILITY; TREATMENT OF LEUKEMIA PHARMACIA & UPJOHN S.P.A. (IT) 1997-02-11 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 (7 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-20050171105-A1 For therapy of benign and malignant proliferative disorders as well as diseases resulting from inappropriate activation of the immune and nervous systems ERBB2, ERBB3, ERBB4 ALDH1A1 3930/4885TSHR 926/4885HSD17B10 4597/4885
US-20050256102-A1 Compounds and methods for inhibiting mitotic progression AURKC, AURKA, AURKB ALDH1A1 3815/4885TSHR 4809/4885HSD17B10 2449/4885
US-20040209922-A1 Pyridine matrix metalloproteinase inhibitors MMP13, MMP3, MMP11 ALDH1A1 544/4885TSHR 3059/4885HSD17B10 516/4885
US-20240109915-A1 NOVEL ACC INHIBITORS CBR3, NAT1, ACACB ALDH1A1 2330/4885TSHR 108/4885HSD17B10 102/4885
US-11014928-B2 Compounds and methods for inhibiting mitotic progression AURKC, AURKA, AURKB ALDH1A1 3815/4885TSHR 4809/4885HSD17B10 2449/4885
US-20020161000-A1 Pyridine matrix metalloproteinase inhibitors MMP13, MMP3, MMP11 ALDH1A1 571/4885TSHR 3181/4885HSD17B10 516/4885
US-20240083906-A1 COMPOUNDS AND METHODS FOR INHIBITING MITOTIC PROGRESSION AURKC, AURKA, AURKB ALDH1A1 3815/4885TSHR 4809/4885HSD17B10 2449/4885

“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.