SCHEMBL10593333

SCHEMBL10593333

S=C=NC(N=C=S)(c1ccccc1)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MIF P14174 10/20 0.42
ALDH1A1 P00352 2/20 0.38
TRPA1 O75762 2/20 0.38
CYP3A4 P08684 1/20 0.38
HPGD P15428 1/20 0.38
KCNN4 O15554 3/20 0.36
TSHR P16473 2/20 0.36
CYP2E1 P05181 1/20 0.35
CYP2A6 P11509 1/20 0.35
HIF1A Q16665 1/20 0.35
CYP2A13 Q16696 1/20 0.35
EPAS1 Q99814 1/20 0.35
MAPK1 P28482 1/20 0.32
NAAA Q02083 3/20 0.31

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
SCHEMBL4386996 0.80 MIF (0.42) MIFALDH1A1TRPA1CYP3A4HPGD
(Isothiocyanatomethanetriyl)Tribenzene SCHEMBL957836 0.80 MIF (0.42) MIFALDH1A1TRPA1CYP3A4HPGD
SCHEMBL8763183 0.76 MIF (0.39) MIFALDH1A1TRPA1CYP3A4HPGD
SCHEMBL5573140 0.76 ALDH1A1 (0.44) MIFALDH1A1TRPA1CYP3A4HPGD
SCHEMBL6889221 0.76 MIF (0.39) MIFALDH1A1TRPA1CYP3A4HPGD
SCHEMBL2241061 0.76 MIF (0.39) MIFALDH1A1TRPA1CYP3A4HPGD
SCHEMBL15413 0.75 KCNN4 (0.36) ALDH1A1KCNN4TSHRHIF1AMAPK1
SCHEMBL1149592 0.75 KCNN4 (0.36) ALDH1A1KCNN4TSHRHIF1AMAPK1
Water SCHEMBL10334361 0.73 KCNN4 (0.35) ALDH1A1KCNN4TSHRHIF1AMAPK1
SCHEMBL19128956 0.73 KCNN4 (0.35) ALDH1A1KCNN4TSHRHIF1AMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114411187-A Nitrogen-sulfur-doped porous carbon electrode material and preparation method and application thereof 万华化学集团股份有限公司 2022-04-29 CN claimed
US-4154913-A ADDITION POLYMER ENDCAPPED WITH POLYISOCYANATE THE FIRESTONE TIRE & RUBBER COMPANY (US) 1979-05-15 US claimed
US-4070344-A WITH POLYISOCYANATE, AMIDE, HYDROLYSIS THE FIRESTONE TIRE AND RUBBER COMPANY (US) 1978-01-24 US claimed
US-20260055216-A1 Conjugated Diene-Based Polymer, Formed Body, Production Method for Conjugated Diene-Based Polymer, Rubber Composition, and Tire ASAHI KASEI KABUSHIKI KAISHA (JP) 2026-02-26 US disclosed
EP-4570827-A1 CONJUGATED DIENE-BASED POLYMER, MOLDED BODY, PRODUCTION METHOD FOR CONJUGATED DIENE-BASED POLYMER, RUBBER COMPOSITION, AND TIRE Asahi Kasei Kabushiki Kaisha (JP) 2025-06-18 EP disclosed
WO-2025028621-A1 MODIFIED CONJUGATED DIENE POLYMER, BALE, METHOD FOR PRODUCING MODIFIED CONJUGATED DIENE POLYMER, RUBBER COMPOSITION, AND TIRE 旭化成株式会社 2025-02-06 WO disclosed
WO-2024034673-A1 CONJUGATED DIENE-BASED POLYMER, MOLDED BODY, PRODUCTION METHOD FOR CONJUGATED DIENE-BASED POLYMER, RUBBER COMPOSITION, AND TIRE 旭化成株式会社 2024-02-15 WO disclosed
CN-114411187-B Nitrogen-sulfur doped porous carbon electrode material and preparation method and application thereof 万华化学集团股份有限公司 2023-10-17 CN disclosed
CN-114411187-A Nitrogen-sulfur-doped porous carbon electrode material and preparation method and application thereof 万华化学集团股份有限公司 2022-04-29 CN disclosed
CN-110506062-B Modified conjugated diene polymer, polymer composition, and rubber composition 旭化成株式会社 2022-02-22 CN disclosed
US-11225534-B2 Modified conjugated diene-based polymer, polymer composition, and rubber composition ASAHI KASEI KABUSHIKI KAISHA (JP) 2022-01-18 US disclosed
US-4157429-A Amine terminated polymers and the formation of block copolymers THE FIRESTONE TIRE & RUBBER COMPANY (US) 1979-06-05 US disclosed
US-4157430-A Amine terminated polymers and the formation of block copolymers THE FIRESTONE TIRE & RUBBER COMPANY (US) 1979-06-05 US disclosed
US-4155947-A Amine terminated polymers and the formation of blocked copolymers THE FIRESTONE TIRE & RUBBER COMPANY (US) 1979-05-22 US disclosed
US-4155948-A Amine terminated polymers and the formation of blocked copolymers THE FIRESTONE TIRE & RUBBER COMPANY (US) 1979-05-22 US disclosed
US-4154772-A PHENOLIC RESIN CONNECTED TO ADDITION POLYMER THE FIRESTONE TIRE & RUBBER COMPANY (US) 1979-05-15 US disclosed
US-4154773-A UREA-ALDEHYDE POLYMER COUPLED TO ADDITION POLYMER THE FIRESTONE TIRE & RUBBER COMPANY (US) 1979-05-15 US disclosed
US-4154913-A ADDITION POLYMER ENDCAPPED WITH POLYISOCYANATE THE FIRESTONE TIRE & RUBBER COMPANY (US) 1979-05-15 US disclosed
US-4151222-A Amine terminated polymers and the formation of block copolymers THE FIRESTONE TIRE & RUBBER COMPANY (US) 1979-04-24 US disclosed
US-4070344-A WITH POLYISOCYANATE, AMIDE, HYDROLYSIS THE FIRESTONE TIRE AND RUBBER COMPANY (US) 1978-01-24 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 (1 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-20260055216-A1 Conjugated Diene-Based Polymer, Formed Body, Production Method for Conjugated Diene-Based Polymer, Rubber Composition, and Tire HMGB2, HMGB1, HMGB3 MIF 70/4885ALDH1A1 2948/4885TRPA1 3887/4885

“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.